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Benzyl (E)-ferulate
SpectraBase Compound ID FLRwCFU1y1h
InChI InChI=1S/C17H16O4/c1-20-16-11-13(7-9-15(16)18)8-10-17(19)21-12-14-5-3-2-4-6-14/h2-11,18H,12H2,1H3/b10-8+
InChIKey DZAPHTCUSDTZAT-CSKARUKUSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWIO7wiNH4y
Name Benzyl (E)-ferulate
CAS Registry Number 132335-97-8
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 284.104858991 u
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-20-16-11-13(7-9-15(16)18)8-10-17(19)21-12-14-5-3-2-4-6-14/h2-11,18H,12H2,1H3/b10-8+
InChIKey DZAPHTCUSDTZAT-CSKARUKUSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 284.311 g/mol
Nominal Mass 284 u
Quality 948
Retention Index 2098
SMILES OC=1C(=CC(=CC1)\C=C\C(OCC=1C=CC=CC1)=O)OC
SPLASH splash10-0f7o-5950000000-24987737ffb143006817
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzyl(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Technique GC/MS
Wiley ID DD2024_026418