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Octadecanoic acid, 2-mercapto-

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Octadecanoic acid, 2-mercapto-
SpectraBase Compound ID 6W68sTaHHXV
InChI InChI=1S/C18H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(21)18(19)20/h17,21H,2-16H2,1H3,(H,19,20)
InChIKey NTKCAHRZWRIYFH-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C18H36O2S
Exact Mass 316.243602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FUdFC4NrzB
Name Octadecanoic acid, 2-mercapto-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O2S
InChI InChI=1S/C18H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(21)18(19)20/h17,21H,2-16H2,1H3,(H,19,20)
InChIKey NTKCAHRZWRIYFH-UHFFFAOYSA-N
Molecular Weight 316.544 g/mol
SMILES SC(C(O)=O)CCCCCCCCCCCCCCCC
SPLASH splash10-00kf-9221000000-0bb6ea53e371f8689806
Source of Spectrum JX-2015-3-142
Synonyms 2-Mercaptooctadecanoic acid 2-Sulfanyloctadecanoic acid
Wiley ID 1723735