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2H-Pyrrole, 3,4-dihydro-2,2-dimethyl-5-(methylthio)-3-phenyl-, 1-oxide
SpectraBase Compound ID Hj0KAuNJBa6
InChI InChI=1S/C13H17NOS/c1-13(2)11(9-12(16-3)14(13)15)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey LZGALDYNIGHMCH-UHFFFAOYSA-N
Mol Weight 235.34 g/mol
Molecular Formula C13H17NOS
Exact Mass 235.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmDQ9tLm1vs
Name 2H-Pyrrole, 3,4-dihydro-2,2-dimethyl-5-(methylthio)-3-phenyl-, 1-oxide
Alternate Name(s) 2,2-Dimethyl-1-oxido-3-phenyl-3,4-dihydro-2H-pyrrol-5-yl methyl sulfide 2,2-Dimethyl-5-(methylsulfanyl)-3-phenyl-3,4-dihydro-2H-pyrrole 1-oxide 5,5-Dimethyl-2-methylthio-4-phenyl-1-pyrroline-1-oxide
CAS Registry Number 118699-59-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NOS
InChI InChI=1S/C13H17NOS/c1-13(2)11(9-12(16-3)14(13)15)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey LZGALDYNIGHMCH-UHFFFAOYSA-N
Molecular Weight 235.345 g/mol
SMILES C1([N+](=C(CC1c1ccccc1)SC)[O-])(C)C
SPLASH splash10-0gbi-1970000000-8eba756f27162c12e5fb
Source of Spectrum B-41-45-7
Wiley ID 1237076