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Dodecyl (E)-ferulate
SpectraBase Compound ID JuqWX2anuOY
InChI InChI=1S/C22H34O4/c1-3-4-5-6-7-8-9-10-11-12-17-26-22(24)16-14-19-13-15-20(23)21(18-19)25-2/h13-16,18,23H,3-12,17H2,1-2H3/b16-14+
InChIKey GSGVKEOQRLQPPH-JQIJEIRASA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Vk6YSdPHv7
Name Dodecyl (E)-ferulate
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 362.245709571 u
Formula C22H34O4
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C22H34O4/c1-3-4-5-6-7-8-9-10-11-12-17-26-22(24)16-14-19-13-15-20(23)21(18-19)25-2/h13-16,18,23H,3-12,17H2,1-2H3/b16-14+
InChIKey GSGVKEOQRLQPPH-JQIJEIRASA-N
Molecular Weight 362.510 g/mol
Nominal Mass 362 u
Number of Peaks 65
SMILES Oc1c(cc(\C=C\C(=O)OCCCCCCCCCCCC)cc1)OC
SPLASH splash10-0006-3900000000-c1a3922cb4f508e72820
Source Synthesis, L. Wroblewski
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI001024