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(1-butyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-phenyl-methanone
SpectraBase Compound ID BfR6VDyUKRb
InChI InChI=1S/C17H21NOS/c1-4-5-11-18-13(2)12-15(17(18)20-3)16(19)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3
InChIKey BOJQXXWFQIALGL-UHFFFAOYSA-N
Mol Weight 287.42 g/mol
Molecular Formula C17H21NOS
Exact Mass 287.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkYwclGRnLZ
Name (1-butyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NOS
InChI InChI=1S/C17H21NOS/c1-4-5-11-18-13(2)12-15(17(18)20-3)16(19)14-9-7-6-8-10-14/h6-10,12H,4-5,11H2,1-3H3
InChIKey BOJQXXWFQIALGL-UHFFFAOYSA-N
Molecular Weight 287.421 g/mol
SMILES c1(c([n](CCCC)c(c1)C)SC)C(=O)c1ccccc1
SPLASH splash10-0f79-0090000000-1828bda56b16e59d71af
Source of Spectrum KC-0-1726-11
Synonyms [1-butyl-5-methyl-2-(methylthio)-3-pyrrolyl]-phenylmethanone [1-butyl-5-methyl-2-(methylthio)pyrrol-3-yl]-phenyl-methanone
Wiley ID 784066