Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-4-oxocyclohexanecarbonitrile
Catalog ID
STL059155
SMILES N#CC1(CCC(=O)CC1)c1ccc(c(c1)OC)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H17NO3 MW 259.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO3/c1-18-13-4-3-11(9-14(13)19-2)15(10-16)7-5-12(17)6-8-15/h3-4,9H,5-8H2,1-2H3InChIKey
DGEFSVRXOCLHAY-UHFFFAOYSA-NSynonyms
1(34DIMETHOXYPHENYL)4OXOCYCLOHEXANE1CARBONITRILE
1(34dimethoxyphenyl)4oxocyclohexanecarbonitrile
4(34DIMETHOXYPHENYL)4CYANOCYCLOHEXANONE
4CYANO4(34DIMETHOXYPHENYL)CYCLOHEXANONE
51533654
COC1=C(C=C(C=C1)C2(CCC(=O)CC2)C#N)OC
CYCLOHEXANECARBONITRILE1(34DIMETHOXYPHENYL)4OXO
InChI=1SC15H17NO3c118134311(914(13)192)15(1016)7512(17)6815h349H58H212H3
MFCD00425975
ZINC000000197805
ZINC00197805
ZINC197805
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