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Henicosa-6-yn-20-en-1-oic Acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Henicosa-6-yn-20-en-1-oic Acid
SpectraBase Compound ID 6vKdN9yRGDN
InChI InChI=1S/C21H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2H,1,3-14,17-20H2,(H,22,23)
InChIKey FBZHCWZWZBCJJE-UHFFFAOYSA-N
Mol Weight 320.5 g/mol
Molecular Formula C21H36O2
Exact Mass 320.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27v2Hc3mLfD
Name Henicosa-6-yn-20-en-1-oic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O2
InChI InChI=1S/C21H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2H,1,3-14,17-20H2,(H,22,23)
InChIKey FBZHCWZWZBCJJE-UHFFFAOYSA-N
Molecular Weight 320.517 g/mol
SMILES OC(CCCCC#CCCCCCCCCCCCCC=C)=O
SPLASH splash10-000x-9500000000-3f62550f62f4db700bf5
Source of Spectrum E1-57-862-1
Synonyms Henicos-20-en-6-ynoic acid
Wiley ID 1661694