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(2-methylsulfanyl-1-propyl-pyrrol-3-yl)-phenyl-methanone
SpectraBase Compound ID 40E8wDp10jO
InChI InChI=1S/C15H17NOS/c1-3-10-16-11-9-13(15(16)18-2)14(17)12-7-5-4-6-8-12/h4-9,11H,3,10H2,1-2H3
InChIKey XMDDTMGJVZUYMM-UHFFFAOYSA-N
Mol Weight 259.37 g/mol
Molecular Formula C15H17NOS
Exact Mass 259.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nSNn4I7j6g
Name (2-methylsulfanyl-1-propyl-pyrrol-3-yl)-phenyl-methanone
Comments Less than 3 mono-isotopic peaks
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Formula C15H17NOS
InChI InChI=1S/C15H17NOS/c1-3-10-16-11-9-13(15(16)18-2)14(17)12-7-5-4-6-8-12/h4-9,11H,3,10H2,1-2H3
InChIKey XMDDTMGJVZUYMM-UHFFFAOYSA-N
Molecular Weight 259.367 g/mol
SMILES c1([n](ccc1C(c1ccccc1)=O)CCC)SC
SPLASH splash10-0a90-0090000000-657743abd16c467b05e3
Source of Spectrum SO-0-142-3
Synonyms [2-(methylthio)-1-propyl-3-pyrrolyl]-phenylmethanone [2-(methylthio)-1-propyl-pyrrol-3-yl]-phenyl-methanone
Wiley ID 1540462