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

*Links on SpectraBase are not permalinks.
CAFFEIC-ANHYDRIDE
SpectraBase Compound ID I1rQE294CG9
InChI InChI=1S/C18H14O7/c19-13-5-1-11(9-15(13)21)3-7-17(23)25-18(24)8-4-12-2-6-14(20)16(22)10-12/h1-10,19-22H/b7-3+,8-4+
InChIKey QDPOOGQUCJJZAO-FCXRPNKRSA-N
Mol Weight 342.3 g/mol
Molecular Formula C18H14O7
Exact Mass 342.073953 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 HSn0Bb3ZvEI
Name (2E)-3-(3,4-Dihydroxyphenyl)prop-2-enoic Anhydride
Alternate Name(s) Caffeic Anhydride (E)-3-(3,4-dihydroxyphenyl)acrylic anhydride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O7
InChI InChI=1S/C18H14O7/c19-13-5-1-11(9-15(13)21)3-7-17(23)25-18(24)8-4-12-2-6-14(20)16(22)10-12/h1-10,19-22H/b7-3+,8-4+
InChIKey QDPOOGQUCJJZAO-FCXRPNKRSA-N
Literature Reference DOI 10.1002/cbdv.200490161
Molecular Weight 342.303 g/mol
SMILES Oc1c(cc(\C=C\C(OC(\C=C\c2ccc(c(c2)O)O)=O)=O)cc1)O
SPLASH splash10-000i-2900000000-5d35ecc40bc33f29d803
Source of Spectrum CBD-2-110-2
Wiley ID 1796785