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Oxime

Oxime

Organische Verbindungen mit einem Kohlenstoffatom, das über eine Doppelbindung mit einem Stickstoff verbunden ist, wobei der Stickstoff mit einer Hydroxylgruppe verbunden ist, haben die allgemeine Formel: RR'C=NOH, wobei R eine organische Seitenkette ist und R' Wasserstoff sein kann.
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1 – 15 von 31 Ergebnisse
1

Cyclopentanonoxim, 97 %, Thermo Scientific Chemicals

CAS: 1192-28-5 Summenformel: C5H9NO Molekulargewicht (g/mol): 99.13 MDL-Nummer: MFCD00001420 InChI-Schlüssel: YGNXYFLJZILPEK-UHFFFAOYSA-N Synonym: cyclopentanone oxime,cyclopentanoneoxime,cyclopentanone, oxime,unii-qy3bv00pcy,ccris 7163,qy3bv00pcy,n-1e-cyclopentylidene hydroxylamine,hydroxyimino cyclopentane,cyclopentanone,oxime,hydroxyiminocyclopentane PubChem CID: 14500 IUPAC-Name: N-cyclopentylidenehydroxylamine SMILES: ON=C1CCCC1

InChI-Schlüssel YGNXYFLJZILPEK-UHFFFAOYSA-N
IUPAC-Name N-cyclopentylidenehydroxylamine
PubChem CID 14500
CAS 1192-28-5
MDL-Nummer MFCD00001420
Molekulargewicht (g/mol) 99.13
SMILES ON=C1CCCC1
Synonym cyclopentanone oxime,cyclopentanoneoxime,cyclopentanone, oxime,unii-qy3bv00pcy,ccris 7163,qy3bv00pcy,n-1e-cyclopentylidene hydroxylamine,hydroxyimino cyclopentane,cyclopentanone,oxime,hydroxyiminocyclopentane
Summenformel C5H9NO
2

Ethyldisonitrosocyanoacetat, 97 %, Thermo Scientific Chemicals

CAS: 3849-21-6 Summenformel: C5H6N2O3 Molekulargewicht (g/mol): 142.114 MDL-Nummer: MFCD00000625 InChI-Schlüssel: LCFXLZAXGXOXAP-QPJJXVBHSA-N Synonym: ethyl cyanoglyoxylate-2-oxime,ethyl isonitrosocyanoacetate,ethyl cyano hydroxyimino acetate,ethyl hydroxyimino cyanoacetate,ethyl 2-cyano-2-hydroxyimino acetate,ethyl cyano hydroxyimino formate,ethyl oximinocyanoacetate,oxyma,e-ethyl 2-cyano-2-hydroxyimino acetate,acetic acid, cyano hydroxyimino-, ethyl ester PubChem CID: 6400537 IUPAC-Name: Ethyl (2E)-2-Cyano-2-hydroxyiminoacetat SMILES: CCOC(=O)C(=NO)C#N

Sonderaktionen verfügbar
InChI-Schlüssel LCFXLZAXGXOXAP-QPJJXVBHSA-N
IUPAC-Name Ethyl (2E)-2-Cyano-2-hydroxyiminoacetat
PubChem CID 6400537
CAS 3849-21-6
MDL-Nummer MFCD00000625
Molekulargewicht (g/mol) 142.114
SMILES CCOC(=O)C(=NO)C#N
Synonym ethyl cyanoglyoxylate-2-oxime,ethyl isonitrosocyanoacetate,ethyl cyano hydroxyimino acetate,ethyl hydroxyimino cyanoacetate,ethyl 2-cyano-2-hydroxyimino acetate,ethyl cyano hydroxyimino formate,ethyl oximinocyanoacetate,oxyma,e-ethyl 2-cyano-2-hydroxyimino acetate,acetic acid, cyano hydroxyimino-, ethyl ester
Summenformel C5H6N2O3
3

Acetaldoxime, Syn + Anti, 98 %, Thermo Scientific Chemicals

CAS: 107-29-9 Summenformel: C2H5NO Molekulargewicht (g/mol): 59.07 MDL-Nummer: MFCD00002124 MFCD00002124 InChI-Schlüssel: FZENGILVLUJGJX-NSCUHMNNSA-N Synonym: acetaldoxime,z-acetaldehyde oxime,1z-acetaldehyde oxime,acetaldehyde, oxime, 1z,1z-ethanal oxime,nz-n-ethylidenehydroxylamine,acetaldehyde, oxime,acetaldehyde, oxime, z,z-acetaldoxime,cis-acetaldehyde oxime PubChem CID: 5324280 ChEBI: CHEBI:50719 IUPAC-Name: (NZ)-N-Ethylidenhydroxylamin SMILES: C\C=N\O

InChI-Schlüssel FZENGILVLUJGJX-NSCUHMNNSA-N
IUPAC-Name (NZ)-N-Ethylidenhydroxylamin
PubChem CID 5324280
CAS 107-29-9
ChEBI CHEBI:50719
MDL-Nummer MFCD00002124 MFCD00002124
Molekulargewicht (g/mol) 59.07
SMILES C\C=N\O
Synonym acetaldoxime,z-acetaldehyde oxime,1z-acetaldehyde oxime,acetaldehyde, oxime, 1z,1z-ethanal oxime,nz-n-ethylidenehydroxylamine,acetaldehyde, oxime,acetaldehyde, oxime, z,z-acetaldoxime,cis-acetaldehyde oxime
Summenformel C2H5NO
4

4-Nitrobenzaldoxim, 98 %, Thermo Scientific Chemicals

CAS: 1129-37-9 Summenformel: C7H6N2O3 Molekulargewicht (g/mol): 166.14 MDL-Nummer: MFCD00007377 MFCD00007377 MFCD00151329 MFCD00151329 MFCD00165078 InChI-Schlüssel: WTLPAVBACRIHHC-VMPITWQZSA-N Synonym: syn-4-nitrobenzaldoxime,4-nitrobenzaldehyde oxime,p-nitrobenzaldoxime,anti-p-nitrobenzaldoxime,p-nitro-anti-benzaldoxime,wln: wnr d1unq,e-4-nitrobenzaldehyde oxime,4-nitrobenzaldehyde oxime, cis,1z-4-nitrobenzaldehyde oxime,benzaldehyde, p-nitro-, oxime, z PubChem CID: 5374047 SMILES: O\N=C\C1=CC=C(C=C1)[N+]([O-])=O

InChI-Schlüssel WTLPAVBACRIHHC-VMPITWQZSA-N
PubChem CID 5374047
CAS 1129-37-9
MDL-Nummer MFCD00007377 MFCD00007377 MFCD00151329 MFCD00151329 MFCD00165078
Molekulargewicht (g/mol) 166.14
SMILES O\N=C\C1=CC=C(C=C1)[N+]([O-])=O
Synonym syn-4-nitrobenzaldoxime,4-nitrobenzaldehyde oxime,p-nitrobenzaldoxime,anti-p-nitrobenzaldoxime,p-nitro-anti-benzaldoxime,wln: wnr d1unq,e-4-nitrobenzaldehyde oxime,4-nitrobenzaldehyde oxime, cis,1z-4-nitrobenzaldehyde oxime,benzaldehyde, p-nitro-, oxime, z
Summenformel C7H6N2O3
5

2-Butanonoxim 99 %, Thermo Scientific Chemicals

CAS: 96-29-7 Summenformel: C4H9NO Molekulargewicht (g/mol): 87.12 MDL-Nummer: MFCD00013935 InChI-Schlüssel: WHIVNJATOVLWBW-SNAWJCMRSA-N Synonym: mek-oxime,butanone oxime,methyl ethyl ketone oxime,2-butanone oxime,ethyl methyl ketoxime,usaf ek-906,ethyl-methylketonoxim,unii-51yge935u9,2-butanone, oxime,methyl ethyl ketoxime PubChem CID: 5324276 IUPAC-Name: (NZ)-N-Butan-2-ylidenhydroxylamin SMILES: CC\C(C)=N\O

InChI-Schlüssel WHIVNJATOVLWBW-SNAWJCMRSA-N
IUPAC-Name (NZ)-N-Butan-2-ylidenhydroxylamin
PubChem CID 5324276
CAS 96-29-7
MDL-Nummer MFCD00013935
Molekulargewicht (g/mol) 87.12
SMILES CC\C(C)=N\O
Synonym mek-oxime,butanone oxime,methyl ethyl ketone oxime,2-butanone oxime,ethyl methyl ketoxime,usaf ek-906,ethyl-methylketonoxim,unii-51yge935u9,2-butanone, oxime,methyl ethyl ketoxime
Summenformel C4H9NO
6

Acetonoxim 98 %, Thermo Scientific Chemicals

CAS: 127-06-0 Summenformel: C3H7NO Molekulargewicht (g/mol): 73.10 MDL-Nummer: MFCD00002118 InChI-Schlüssel: PXAJQJMDEXJWFB-UHFFFAOYSA-N Synonym: acetone oxime,acetoxime,propan-2-one oxime,2-propanone, oxime,2-propanone oxime,acetonoxime,acetone, oxime,beta-isonitrosopropane,acetoneoxime,ccris 5 PubChem CID: 67180 ChEBI: CHEBI:15349 IUPAC-Name: N-Propan-2-ylidenhydroxylamin SMILES: CC(C)=NO

InChI-Schlüssel PXAJQJMDEXJWFB-UHFFFAOYSA-N
IUPAC-Name N-Propan-2-ylidenhydroxylamin
PubChem CID 67180
CAS 127-06-0
ChEBI CHEBI:15349
MDL-Nummer MFCD00002118
Molekulargewicht (g/mol) 73.10
SMILES CC(C)=NO
Synonym acetone oxime,acetoxime,propan-2-one oxime,2-propanone, oxime,2-propanone oxime,acetonoxime,acetone, oxime,beta-isonitrosopropane,acetoneoxime,ccris 5
Summenformel C3H7NO
7

Acetaldehydoxim, 99 %, Syn/anti-Gemisch, Thermo Scientific Chemicals

CAS: 107-29-9 Summenformel: C2H5NO Molekulargewicht (g/mol): 59.07 MDL-Nummer: MFCD00002124 MFCD00002124 InChI-Schlüssel: FZENGILVLUJGJX-NSCUHMNNSA-N Synonym: acetaldoxime,z-acetaldehyde oxime,1z-acetaldehyde oxime,acetaldehyde, oxime, 1z,1z-ethanal oxime,nz-n-ethylidenehydroxylamine,acetaldehyde, oxime,acetaldehyde, oxime, z,z-acetaldoxime,cis-acetaldehyde oxime PubChem CID: 5324280 ChEBI: CHEBI:50719 IUPAC-Name: (NZ)-N-Ethylidenhydroxylamin SMILES: C\C=N\O

InChI-Schlüssel FZENGILVLUJGJX-NSCUHMNNSA-N
IUPAC-Name (NZ)-N-Ethylidenhydroxylamin
PubChem CID 5324280
CAS 107-29-9
ChEBI CHEBI:50719
MDL-Nummer MFCD00002124 MFCD00002124
Molekulargewicht (g/mol) 59.07
SMILES C\C=N\O
Synonym acetaldoxime,z-acetaldehyde oxime,1z-acetaldehyde oxime,acetaldehyde, oxime, 1z,1z-ethanal oxime,nz-n-ethylidenehydroxylamine,acetaldehyde, oxime,acetaldehyde, oxime, z,z-acetaldoxime,cis-acetaldehyde oxime
Summenformel C2H5NO
8

3,4-Dichlorbenzaldoxime, 98 %

CAS: 5331-92-0 Summenformel: C7H5Cl2NO Molekulargewicht (g/mol): 190.02 MDL-Nummer: MFCD00017592 InChI-Schlüssel: ROBIUDOANJUDHD-ONNFQVAWSA-N Synonym: 3,4-dichlorobenzaldoxime,3,4-dichlorobenzaldehyde oxime,1e-3,4-dichlorobenzaldehyde oxime,e-n-3,4-dichlorophenyl methylidene hydroxylamine,ne-n-3,4-dichlorophenyl methylidene hydroxylamine,3,4-dichlorophenyl hydroxyimino methane,3,4-dichlorobenzaldehyde oxime #,z-n-3,4-dichlorophenyl methylidene hydroxylamine PubChem CID: 5704835 IUPAC-Name: (NE)-N-[(3,4-dichlorphenyl)methyliden]hydroxylamin SMILES: O\N=C\C1=CC=C(Cl)C(Cl)=C1

InChI-Schlüssel ROBIUDOANJUDHD-ONNFQVAWSA-N
IUPAC-Name (NE)-N-[(3,4-dichlorphenyl)methyliden]hydroxylamin
PubChem CID 5704835
CAS 5331-92-0
MDL-Nummer MFCD00017592
Molekulargewicht (g/mol) 190.02
SMILES O\N=C\C1=CC=C(Cl)C(Cl)=C1
Synonym 3,4-dichlorobenzaldoxime,3,4-dichlorobenzaldehyde oxime,1e-3,4-dichlorobenzaldehyde oxime,e-n-3,4-dichlorophenyl methylidene hydroxylamine,ne-n-3,4-dichlorophenyl methylidene hydroxylamine,3,4-dichlorophenyl hydroxyimino methane,3,4-dichlorobenzaldehyde oxime #,z-n-3,4-dichlorophenyl methylidene hydroxylamine
Summenformel C7H5Cl2NO
9

Acetophenonoxim, 98 %, Thermo Scientific Chemicals

CAS: 613-91-2 Summenformel: C8H9NO Molekulargewicht (g/mol): 135.17 MDL-Nummer: MFCD00013931 MFCD00013931 InChI-Schlüssel: JHNRZXQVBKRYKN-VQHVLOKHSA-N Synonym: acetophenone oxime,ethanone, 1-phenyl-, oxime,acetophenone, oxime,methyl phenyl ketone oxime,methyl phenyl ketoxime,1-phenylethanone oxime,z-acetophenone oxime,n-1-phenylethylidene hydroxylamine,e-n-1-phenylethylidene hydroxylamine,ne-n-1-phenylethylidene hydroxylamine PubChem CID: 5464950 IUPAC-Name: (NE)-N-(1-Phenylethyliden)hydroxylamin SMILES: C\C(=N/O)C1=CC=CC=C1

InChI-Schlüssel JHNRZXQVBKRYKN-VQHVLOKHSA-N
IUPAC-Name (NE)-N-(1-Phenylethyliden)hydroxylamin
PubChem CID 5464950
CAS 613-91-2
MDL-Nummer MFCD00013931 MFCD00013931
Molekulargewicht (g/mol) 135.17
SMILES C\C(=N/O)C1=CC=CC=C1
Synonym acetophenone oxime,ethanone, 1-phenyl-, oxime,acetophenone, oxime,methyl phenyl ketone oxime,methyl phenyl ketoxime,1-phenylethanone oxime,z-acetophenone oxime,n-1-phenylethylidene hydroxylamine,e-n-1-phenylethylidene hydroxylamine,ne-n-1-phenylethylidene hydroxylamine
Summenformel C8H9NO
10

3-Hydroxy-3-methyl-2-butanonoxim, 98 %, Thermo Scientific™

CAS: 7431-25-6 Summenformel: C5H11NO2 Molekulargewicht (g/mol): 117.148 MDL-Nummer: MFCD00059656 InChI-Schlüssel: QKLLBCGVADVPKD-XQRVVYSFSA-N Synonym: 3-hydroxy-3-methyl-2-butanone oxime,3e-3-hydroxyimino-2-methylbutan-2-ol,qkllbcgvadvpkd-xqrvvysfsa,3-hydroxy-3-methyl-butan-2-one oxime,3z-3-hydroxyimino-2-methylbutan-2-ol,3e-3-hydroxyimino-2-methyl-butan-2-ol,2z-3-hydroxy-3-methyl-2-butanone oxime # PubChem CID: 5385758 IUPAC-Name: (3Z)-3-Hydroxyimino-2-Methylbutan-2-ol SMILES: CC(=NO)C(C)(C)O

InChI-Schlüssel QKLLBCGVADVPKD-XQRVVYSFSA-N
IUPAC-Name (3Z)-3-Hydroxyimino-2-Methylbutan-2-ol
PubChem CID 5385758
CAS 7431-25-6
MDL-Nummer MFCD00059656
Molekulargewicht (g/mol) 117.148
SMILES CC(=NO)C(C)(C)O
Synonym 3-hydroxy-3-methyl-2-butanone oxime,3e-3-hydroxyimino-2-methylbutan-2-ol,qkllbcgvadvpkd-xqrvvysfsa,3-hydroxy-3-methyl-butan-2-one oxime,3z-3-hydroxyimino-2-methylbutan-2-ol,3e-3-hydroxyimino-2-methyl-butan-2-ol,2z-3-hydroxy-3-methyl-2-butanone oxime #
Summenformel C5H11NO2
11

Acetone oxim, 98 %, Thermo Scientific Chemicals

CAS: 127-06-0 Summenformel: C3H7NO Molekulargewicht (g/mol): 73.10 MDL-Nummer: MFCD00002118 InChI-Schlüssel: PXAJQJMDEXJWFB-UHFFFAOYSA-N Synonym: acetone oxime,acetoxime,propan-2-one oxime,2-propanone, oxime,2-propanone oxime,acetonoxime,acetone, oxime,beta-isonitrosopropane,acetoneoxime,ccris 5 PubChem CID: 67180 ChEBI: CHEBI:15349 IUPAC-Name: N-Propan-2-ylidenhydroxylamin SMILES: CC(C)=NO

InChI-Schlüssel PXAJQJMDEXJWFB-UHFFFAOYSA-N
IUPAC-Name N-Propan-2-ylidenhydroxylamin
PubChem CID 67180
CAS 127-06-0
ChEBI CHEBI:15349
MDL-Nummer MFCD00002118
Molekulargewicht (g/mol) 73.10
SMILES CC(C)=NO
Synonym acetone oxime,acetoxime,propan-2-one oxime,2-propanone, oxime,2-propanone oxime,acetonoxime,acetone, oxime,beta-isonitrosopropane,acetoneoxime,ccris 5
Summenformel C3H7NO
12

2-Octanon-Oxim 99 %, Thermo Scientific™

CAS: 7207-49-0 Summenformel: C8H17NO Molekulargewicht (g/mol): 143.23 MDL-Nummer: MFCD00089167 InChI-Schlüssel: GZRPVYSKBVDCBV-HJWRWDBZSA-N Synonym: 2-octanone, oxime,2-octanone oxime,n-octan-2-ylidene hydroxylamine,2-hydroxyiminooctane,z-n-octan-2-ylidene hydroxylamine PubChem CID: 9562584 IUPAC-Name: (Z)-N-(octan-2-ylidene)hydroxylamine SMILES: CCCCCC\C(C)=N/O

InChI-Schlüssel GZRPVYSKBVDCBV-HJWRWDBZSA-N
IUPAC-Name (Z)-N-(octan-2-ylidene)hydroxylamine
PubChem CID 9562584
CAS 7207-49-0
MDL-Nummer MFCD00089167
Molekulargewicht (g/mol) 143.23
SMILES CCCCCC\C(C)=N/O
Synonym 2-octanone, oxime,2-octanone oxime,n-octan-2-ylidene hydroxylamine,2-hydroxyiminooctane,z-n-octan-2-ylidene hydroxylamine
Summenformel C8H17NO
13

2,6-Dichlorbenzaldoxime, 97 %, Thermo Scientific Chemicals

CAS: 25185-95-9 Summenformel: C7H5Cl2NO Molekulargewicht (g/mol): 190.02 MDL-Nummer: MFCD00013938 InChI-Schlüssel: YBSXDWIAUZOFFV-ONNFQVAWSA-N Synonym: 2,6-dichlorobenzaldoxime,2,6-dichlorobenzaldehyde oxime,2,6-dichlorobenzaloxime,2,6-dichloro benzyloxime,z-2,6-dichlorobenzaldehyde oxime,2,6-dichlorophenyl hydroxyimino methane,z-n-2,6-dichlorophenyl methylidene hydroxylamine,z-2,6-dichlorobenzaldehydeoxime,e-n-2,6-dichlorophenyl methylidene hydroxylamine,e-2,6-dichlorobenzaldehyde oxime PubChem CID: 9581041 IUPAC-Name: (NE)-N-[(2,6-dichlorphenyl)methyliden]hydroxylamin SMILES: O\N=C\C1=C(Cl)C=CC=C1Cl

InChI-Schlüssel YBSXDWIAUZOFFV-ONNFQVAWSA-N
IUPAC-Name (NE)-N-[(2,6-dichlorphenyl)methyliden]hydroxylamin
PubChem CID 9581041
CAS 25185-95-9
MDL-Nummer MFCD00013938
Molekulargewicht (g/mol) 190.02
SMILES O\N=C\C1=C(Cl)C=CC=C1Cl
Synonym 2,6-dichlorobenzaldoxime,2,6-dichlorobenzaldehyde oxime,2,6-dichlorobenzaloxime,2,6-dichloro benzyloxime,z-2,6-dichlorobenzaldehyde oxime,2,6-dichlorophenyl hydroxyimino methane,z-n-2,6-dichlorophenyl methylidene hydroxylamine,z-2,6-dichlorobenzaldehydeoxime,e-n-2,6-dichlorophenyl methylidene hydroxylamine,e-2,6-dichlorobenzaldehyde oxime
Summenformel C7H5Cl2NO
14

Alpha-Benzoin-Oxim, 98 %, Thermo Scientific Chemicals

CAS: 441-38-3 Summenformel: C14H13NO2 Molekulargewicht (g/mol): 227.26 MDL-Nummer: MFCD00004501 InChI-Schlüssel: WAKHLWOJMHVUJC-FYWRMAATNA-N Synonym: 2-hydroxy-1,2-diphenylethanone oxime,e,alphar-benzoinoxime,2r-2-hydroxy-1,2-diphenylethanone oxime,1r,2z-2-hydroxyimino-1,2-diphenylethanol,1r,2z-2-hydroxyimino-1,2-diphenyl-ethanol,unii-ptc1433kj8 component PubChem CID: 7057888 IUPAC-Name: (2E)-2-(N-hydroxyimino)-1,2-diphenylethan-1-ol SMILES: O\N=C(\C(O)C1=CC=CC=C1)C1=CC=CC=C1

InChI-Schlüssel WAKHLWOJMHVUJC-FYWRMAATNA-N
IUPAC-Name (2E)-2-(N-hydroxyimino)-1,2-diphenylethan-1-ol
PubChem CID 7057888
CAS 441-38-3
MDL-Nummer MFCD00004501
Molekulargewicht (g/mol) 227.26
SMILES O\N=C(\C(O)C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-hydroxy-1,2-diphenylethanone oxime,e,alphar-benzoinoxime,2r-2-hydroxy-1,2-diphenylethanone oxime,1r,2z-2-hydroxyimino-1,2-diphenylethanol,1r,2z-2-hydroxyimino-1,2-diphenyl-ethanol,unii-ptc1433kj8 component
Summenformel C14H13NO2
15

2,4-Dimethoxybenzaldoxim, 97 %, Thermo Scientific™

CAS: 31874-34-7 Summenformel: C9H11NO3 Molekulargewicht (g/mol): 181.191 MDL-Nummer: MFCD00082783 InChI-Schlüssel: SFDRVCQSVTYHLU-UXBLZVDNSA-N Synonym: 2,4-dimethoxybenzaldoxime,2,4-dimethoxybenzaldehyde oxime,e-n-2,4-dimethoxyphenyl methylidene hydroxylamine,benzaldehyde, 2,4-dimethoxy-, oxime,2.4-dimethoxybenzaldoxim,e-2,4-dimethoxybenzaldehyde oxime,2,4-dimethoxyphenyl hydroxyimino methane,ne-n-2,4-dimethoxyphenyl methylidene hydroxylamine PubChem CID: 6871293 IUPAC-Name: (NE)-N-[(2,4-Dimethoxyphenyl)methyliden]hydroxylamin SMILES: COC1=CC(=C(C=C1)C=NO)OC

InChI-Schlüssel SFDRVCQSVTYHLU-UXBLZVDNSA-N
IUPAC-Name (NE)-N-[(2,4-Dimethoxyphenyl)methyliden]hydroxylamin
PubChem CID 6871293
CAS 31874-34-7
MDL-Nummer MFCD00082783
Molekulargewicht (g/mol) 181.191
SMILES COC1=CC(=C(C=C1)C=NO)OC
Synonym 2,4-dimethoxybenzaldoxime,2,4-dimethoxybenzaldehyde oxime,e-n-2,4-dimethoxyphenyl methylidene hydroxylamine,benzaldehyde, 2,4-dimethoxy-, oxime,2.4-dimethoxybenzaldoxim,e-2,4-dimethoxybenzaldehyde oxime,2,4-dimethoxyphenyl hydroxyimino methane,ne-n-2,4-dimethoxyphenyl methylidene hydroxylamine
Summenformel C9H11NO3