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(E)-3-[4'-Hydroxy-3'-(1"-methylcyclohexyl)biphenyl-4-yl]-acrylic Acid
SpectraBase Compound ID IzqO4HJ1acG
InChI InChI=1S/C22H24O3/c1-22(13-3-2-4-14-22)19-15-18(10-11-20(19)23)17-8-5-16(6-9-17)7-12-21(24)25/h5-12,15,23H,2-4,13-14H2,1H3,(H,24,25)/b12-7+
InChIKey KSYPSTCJMLLTOU-KPKJPENVSA-N
Mol Weight 336.43 g/mol
Molecular Formula C22H24O3
Exact Mass 336.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImlQme4DBC8
Name (E)-3-[4'-Hydroxy-3'-(1"-methylcyclohexyl)biphenyl-4-yl]-acrylic Acid
Comments Less than 3 mono-isotopic peaks
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Formula C22H24O3
InChI InChI=1S/C22H24O3/c1-22(13-3-2-4-14-22)19-15-18(10-11-20(19)23)17-8-5-16(6-9-17)7-12-21(24)25/h5-12,15,23H,2-4,13-14H2,1H3,(H,24,25)/b12-7+
InChIKey KSYPSTCJMLLTOU-KPKJPENVSA-N
Molecular Weight 336.431 g/mol
SMILES OC(\C=C\c1ccc(-c2cc(c(cc2)O)C2(C)CCCCC2)cc1)=O
SPLASH splash10-000i-0029000000-2f4bfdb918a183477296
Source of Spectrum AF-48-4940-8b
Synonyms (E)-3-[4-[4-hydroxy-3-(1-methylcyclohexyl)phenyl]phenyl]-2-propenoic acid (E)-3-[4-[4-hydroxy-3-(1-methylcyclohexyl)phenyl]phenyl]prop-2-enoic acid (E)-3-[4-[3-(1-methylcyclohexyl)-4-oxidanyl-phenyl]phenyl]prop-2-enoic acid
Wiley ID 1693982