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4-Cyano-4-(3',4'-dimethoxyphenyl)cyclohex-1-enyl acetate
SpectraBase Compound ID 8HrkmeKhBPQ
InChI InChI=1S/C17H19NO4/c1-12(19)22-14-6-8-17(11-18,9-7-14)13-4-5-15(20-2)16(10-13)21-3/h4-6,10H,7-9H2,1-3H3
InChIKey QSRUWUXOVBJKLS-UHFFFAOYSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wOBARAPBOv
Name 4-Cyano-4-(3',4'-dimethoxyphenyl)cyclohex-1-enyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-12(19)22-14-6-8-17(11-18,9-7-14)13-4-5-15(20-2)16(10-13)21-3/h4-6,10H,7-9H2,1-3H3
InChIKey QSRUWUXOVBJKLS-UHFFFAOYSA-N
Molecular Weight 301.342 g/mol
SMILES C1(c2cc(OC)c(cc2)OC)(C#N)CC=C(CC1)OC(=O)C
SPLASH splash10-000i-0900000000-9071f5daafab0a33fd55
Source of Spectrum KC-0-3386-4
Synonyms 4-cyano-4-(3,4-dimethoxyphenyl)-1-cyclohexen-1-yl acetate acetic acid[4-cyano-4-(3,4-dimethoxyphenyl)-1-cyclohexenyl]ester acetic acid[4-cyano-4-(3,4-dimethoxyphenyl)cyclohexen-1-yl]ester [4-cyano-4-(3,4-dimethoxyphenyl)cyclohexen-1-yl]acetate [4-cyano-4-(3,4-dimethoxyphenyl)cyclohexen-1-yl]ethanoate acetic acid [4-cyano-4-(3,4-dimethoxyphenyl)-1-cyclohexenyl] ester [4-cyano-4-(3,4-dimethoxyphenyl)cyclohexen-1-yl] acetate [4-cyano-4-(3,4-dimethoxyphenyl)cyclohexen-1-yl] ethanoate
Wiley ID 831794