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S-Methyl 5-methyl-2-phenylfuran-3-carbothioate
SpectraBase Compound ID 9TvlaK8c9iX
InChI InChI=1S/C13H12O2S/c1-9-8-11(13(14)16-2)12(15-9)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey VOKGWUWWXSVJPT-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C13H12O2S
Exact Mass 232.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zQehln8Kl4
Name S-Methyl 5-methyl-2-phenylfuran-3-carbothioate
Alternate Name(s) 5-Methyl-2-phenyl-3-furancarbothioic acid S-methyl ester 5-Methyl-2-phenyl-furan-3-carbothioic acid S-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O2S
InChI InChI=1S/C13H12O2S/c1-9-8-11(13(14)16-2)12(15-9)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey VOKGWUWWXSVJPT-UHFFFAOYSA-N
Molecular Weight 232.297 g/mol
SMILES c1(c(oc(c1)C)-c1ccccc1)C(=O)SC
SPLASH splash10-0a4i-0930000000-568bf52f64a26e4921e5
Source of Spectrum KC-0-1751-4
Wiley ID 781422