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cis, cis-9,12-Octadecadienoic acid
SpectraBase Compound ID K2IvwUhDzfD
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FDbMzx7L4a
Name Linoleic acid
CAS Registry Number 60-33-3
Comments Generally Recognized as Safe; NTIS Accession Number: PB274475
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 280.240230268 u
Formula C18H32O2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Molecular Weight 280.452 g/mol
Nominal Mass 280 u
Number of Peaks 62
SMILES OC(=O)CCCCCCC\C=C/C\C=C/CCCCC
SPLASH splash10-00ls-9200000000-110a9bffd91dfb27e5cf
Source Forsythia flowers
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000959