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2-Ethyl-2-((1-methyl-1H-pyrrol-2-ylthio)methyl)butane-1-thiol
SpectraBase Compound ID FfCDwAkqUoo
InChI InChI=1S/C12H21NS2/c1-4-12(5-2,9-14)10-15-11-7-6-8-13(11)3/h6-8,14H,4-5,9-10H2,1-3H3
InChIKey LUNXBJGOHZCZLX-UHFFFAOYSA-N
Mol Weight 243.43 g/mol
Molecular Formula C12H21NS2
Exact Mass 243.111542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oqNegJ4djD
Name 2-Ethyl-2-((1-methyl-1H-pyrrol-2-ylthio)methyl)butane-1-thiol
Alternate Name(s) 2-Ethyl-2-(((1-methyl-1H-pyrrol-2-yl)thio)methyl)butane-1-thiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NS2
InChI InChI=1S/C12H21NS2/c1-4-12(5-2,9-14)10-15-11-7-6-8-13(11)3/h6-8,14H,4-5,9-10H2,1-3H3
InChIKey LUNXBJGOHZCZLX-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1098-1071(1998)9_3_289
Molecular Weight 243.427 g/mol
SMILES SCC(CSc1ccc[n]1C)(CC)CC
SPLASH splash10-03di-3910000000-ace8a89d493d754dcdd1
Source of Spectrum HAC-9-292-8
Wiley ID 1783158