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Methanone, bis[3-(mercaptomethyl)-2-methylphenyl]-
SpectraBase Compound ID 2oOcZNjegSo
InChI InChI=1S/C17H18OS2/c1-11-13(9-19)5-3-7-15(11)17(18)16-8-4-6-14(10-20)12(16)2/h3-8,19-20H,9-10H2,1-2H3
InChIKey BYUUOJXSBOPXSX-UHFFFAOYSA-N
Mol Weight 302.45 g/mol
Molecular Formula C17H18OS2
Exact Mass 302.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LazQebVvtnL
Name Methanone, bis[3-(mercaptomethyl)-2-methylphenyl]-
Alternate Name(s) Bis(3-(mercaptomethyl)-2-methylphenyl)ketone bis[2-methyl-3-(sulfanylmethyl)phenyl]methanone
CAS Registry Number 90369-88-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18OS2
InChI InChI=1S/C17H18OS2/c1-11-13(9-19)5-3-7-15(11)17(18)16-8-4-6-14(10-20)12(16)2/h3-8,19-20H,9-10H2,1-2H3
InChIKey BYUUOJXSBOPXSX-UHFFFAOYSA-N
Molecular Weight 302.450 g/mol
SMILES SCc1c(c(C(c2c(c(CS)ccc2)C)=O)ccc1)C
SPLASH splash10-00xr-0090000000-077a237a798e794d45a0
Source of Spectrum J-49-2539-0
Wiley ID 1304611