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1-Benzyl-3-methyl-2-methylthioindole
SpectraBase Compound ID J4BJtlW0vKo
InChI InChI=1S/C17H17NS/c1-13-15-10-6-7-11-16(15)18(17(13)19-2)12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3
InChIKey UHQRSTBMTFEEBL-UHFFFAOYSA-N
Mol Weight 267.39 g/mol
Molecular Formula C17H17NS
Exact Mass 267.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zqAUjCXpDz
Name 1-Benzyl-3-methyl-2-methylthioindole
Alternate Name(s) 1-Benzyl-3-methyl-1H-indol-2-yl methyl sulfide 1-Benzyl-3-methyl-2-(methylsulfanyl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NS
InChI InChI=1S/C17H17NS/c1-13-15-10-6-7-11-16(15)18(17(13)19-2)12-14-8-4-3-5-9-14/h3-11H,12H2,1-2H3
InChIKey UHQRSTBMTFEEBL-UHFFFAOYSA-N
Molecular Weight 267.390 g/mol
SMILES c1([n](c2ccccc2c1C)Cc1ccccc1)SC
SPLASH splash10-00kf-9020000000-c1a741f81306c4f06f4b
Source of Spectrum SO-0-958-6
Wiley ID 1538658