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Hydrocaffeic acid ME2AC            @
SpectraBase Compound ID HO23BZQjMX0
InChI InChI=1S/C14H16O6/c1-9(15)19-12-6-4-11(5-7-14(17)18-3)8-13(12)20-10(2)16/h4,6,8H,5,7H2,1-3H3
InChIKey ZOMMMACGAZZTAO-UHFFFAOYSA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LnwTLZKmPBw
Name Benzenepropanoic acid, 3,4-bis(acetyloxy)-, methyl ester
Alternate Name(s) Methyl 3-[3,4-bis(acetyloxy)phenyl]propanoate 3-(3,4-diacetoxyphenyl)propionic acid methyl ester 3-(3,4-diacetyloxyphenyl)propanoic acid methyl ester Methyl 3-(3,4-diacetoxyphenyl)propanoate Methyl 3-(3,4-diacetyloxyphenyl)propanoate
CAS Registry Number 55044-39-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-9(15)19-12-6-4-11(5-7-14(17)18-3)8-13(12)20-10(2)16/h4,6,8H,5,7H2,1-3H3
InChIKey ZOMMMACGAZZTAO-UHFFFAOYSA-N
Molecular Weight 280.276 g/mol
SMILES CC(=O)Oc1ccc(cc1OC(C)=O)CCC(=O)OC
SPLASH splash10-000t-9710000000-0148650b2d33e797b4e2
Source of Spectrum AD-0-5002-0
Wiley ID 40900