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trans-OCTADEC-11-ENOIC ACID
SpectraBase Compound ID 4HSBdXMrlyf
InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-8H,2-6,9-17H2,1H3,(H,19,20)/b8-7+
InChIKey UWHZIFQPPBDJPM-BQYQJAHWSA-N
Mol Weight 282.5 g/mol
Molecular Formula C18H34O2
Exact Mass 282.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfgLSlP5vFO
Name trans-Vaccenic acid
CAS Registry Number 16833-54-8
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 282.255880333 u
Formula C18H34O2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-8H,2-6,9-17H2,1H3,(H,19,20)/b8-7+
InChIKey UWHZIFQPPBDJPM-BQYQJAHWSA-N
Molecular Weight 282.468 g/mol
Nominal Mass 282 u
Number of Peaks 313
SMILES OC(=O)CCCCCCCCC\C=C\CCCCCC
SPLASH splash10-05o3-9200000000-809e04f94c3c5e615e97
Source Cayman Chemicals
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 11-Octadecenoic acid
Wiley ID VI001803