For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Infectocaryone
SpectraBase Compound ID 9MmgoGWp8zw
InChI InChI=1S/C18H18O4/c1-22-17(21)12-14-8-5-9-15(19)18(14)16(20)11-10-13-6-3-2-4-7-13/h2-7,9-11,14,20H,8,12H2,1H3/b11-10+,18-16-/t14-/m1/s1
InChIKey HAXYQNFQUDHACW-LVJWOEPNSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I0t3oUSk5ua
Name Infectocaryone
Alternate Name(s) 2-[(1R,6Z)-6-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-5-keto-cyclohex-3-en-1-yl]acetic acid methyl ester 2-[(1R,6Z)-6-[(E)-1-hydroxy-3-phenylprop-2-enylidene]-5-oxo-1-cyclohex-3-enyl]acetic acid methyl ester Methyl 2-[(1R,6Z)-5-oxidanylidene-6-[(E)-1-oxidanyl-3-phenyl-prop-2-enylidene]cyclohex-3-en-1-yl]ethanoate Methyl 2-[(1R,6Z)-6-[(E)-1-hydroxy-3-phenyl-prop-2-enylidene]-5-oxo-cyclohex-3-en-1-yl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-22-17(21)12-14-8-5-9-15(19)18(14)16(20)11-10-13-6-3-2-4-7-13/h2-7,9-11,14,20H,8,12H2,1H3/b11-10+,18-16-/t14-/m1/s1
InChIKey HAXYQNFQUDHACW-LVJWOEPNSA-N
Molecular Weight 298.338 g/mol
SMILES O\C(=C\1[C@@](CC(=O)OC)(CC=CC1=O)[H])\C=C\c1ccccc1
SPLASH splash10-01u0-8940000000-bcfb47245ef97a393343
Source of Spectrum KC-57-6194-4
Wiley ID 1625115