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11-Thenoylundecanoic acid
SpectraBase Compound ID LMfOVAfXTTA
InChI InChI=1S/C16H24O3S/c17-14(15-11-9-13-20-15)10-7-5-3-1-2-4-6-8-12-16(18)19/h9,11,13H,1-8,10,12H2,(H,18,19)
InChIKey USABPRVRWVFIFR-UHFFFAOYSA-N
Mol Weight 296.42 g/mol
Molecular Formula C16H24O3S
Exact Mass 296.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LE034Wmcbrc
Name 11-Thenoylundecanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3S
InChI InChI=1S/C16H24O3S/c17-14(15-11-9-13-20-15)10-7-5-3-1-2-4-6-8-12-16(18)19/h9,11,13H,1-8,10,12H2,(H,18,19)
InChIKey USABPRVRWVFIFR-UHFFFAOYSA-N
Molecular Weight 296.425 g/mol
SMILES OC(CCCCCCCCCCC(c1sccc1)=O)=O
SPLASH splash10-01t9-0900000000-fb95446b4c7233e388b1
Source of Spectrum G-55-1550-0
Synonyms 12-oxo-12-(2-thienyl)dodecanoic acid
Wiley ID 748172