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3-(4-Chlorobenzoyl)-1-isopropyl-5-methyl-2-(methylsulfanyl)pyrrole
SpectraBase Compound ID ENDjwz4GzlA
InChI InChI=1S/C16H18ClNOS/c1-10(2)18-11(3)9-14(16(18)20-4)15(19)12-5-7-13(17)8-6-12/h5-10H,1-4H3
InChIKey LSLVTWYLYYWCAR-UHFFFAOYSA-N
Mol Weight 307.84 g/mol
Molecular Formula C16H18ClNOS
Exact Mass 307.079763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZuXJZ8aeUy
Name 3-(4-Chlorobenzoyl)-1-isopropyl-5-methyl-2-(methylsulfanyl)pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18ClNOS
InChI InChI=1S/C16H18ClNOS/c1-10(2)18-11(3)9-14(16(18)20-4)15(19)12-5-7-13(17)8-6-12/h5-10H,1-4H3
InChIKey LSLVTWYLYYWCAR-UHFFFAOYSA-N
Molecular Weight 307.839 g/mol
SMILES c1(c([n](C(C)C)c(c1)C)SC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-0a4i-0039000000-883d0fac88e1f6a6c139
Source of Spectrum KC-0-1726-11
Synonyms (4-chlorophenyl)[1-isopropyl-5-methyl-2-(methylsulfanyl)-1H-pyrrol-3-yl]methanone (4-chlorophenyl)-[5-methyl-2-(methylthio)-1-propan-2-yl-3-pyrrolyl]methanone (4-chlorophenyl)-(5-methyl-2-methylsulfanyl-1-propan-2-ylpyrrol-3-yl)methanone (4-chlorophenyl)-(1-isopropyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)methanone (4-chlorophenyl)-(5-methyl-2-methylsulfanyl-1-propan-2-yl-pyrrol-3-yl)methanone
Wiley ID 784067