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4-Hexadecen-3-one, 1-(4-hydroxy-3-methoxyphenyl)-, (Z)-
SpectraBase Compound ID Bq1BO5XhSec
InChI InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)17-15-20-16-18-22(25)23(19-20)26-2/h13-14,16,18-19,25H,3-12,15,17H2,1-2H3/b14-13-
InChIKey WCQFXNQALHURHS-YPKPFQOOSA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSecR2bcqLx
Name 4-Hexadecen-3-one, 1-(4-hydroxy-3-methoxyphenyl)-, (Z)-
CAS Registry Number 104264-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)17-15-20-16-18-22(25)23(19-20)26-2/h13-14,16,18-19,25H,3-12,15,17H2,1-2H3/b14-13-
InChIKey WCQFXNQALHURHS-YPKPFQOOSA-N
Molecular Weight 360.538 g/mol
SMILES Oc1c(cc(cc1)CCC(\C=C/CCCCCCCCCCC)=O)OC
SPLASH splash10-000i-4902000000-090c9a6bc764fe6f9c3f
Source of Spectrum JC-360-182-0
Synonyms (4Z)-1-(4-hydroxy-3-methoxyphenyl)-4-hexadecen-3-one cis-12-Shogaol
Wiley ID 1348664