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5(2H)-Thiazolone, 2,2-dimethyl-4-[(phenylmethyl)thio]-
SpectraBase Compound ID 2c4BIvW6VcB
InChI InChI=1S/C12H13NOS2/c1-12(2)13-10(11(14)16-12)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey TUWVPTJZJQRBCN-UHFFFAOYSA-N
Mol Weight 251.36 g/mol
Molecular Formula C12H13NOS2
Exact Mass 251.043856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDaDoTtwq1b
Name 5(2H)-Thiazolone, 2,2-dimethyl-4-[(phenylmethyl)thio]-
CAS Registry Number 113270-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NOS2
InChI InChI=1S/C12H13NOS2/c1-12(2)13-10(11(14)16-12)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey TUWVPTJZJQRBCN-UHFFFAOYSA-N
Molecular Weight 251.362 g/mol
SMILES C1(=NC(SC1=O)(C)C)SCc1ccccc1
SPLASH splash10-0udi-5930000000-5f63cc5fc5891ec5983c
Source of Spectrum H-70-1386-3
Synonyms 2,2-Dimethyl-4-(phenylmethylthio)-5-thiazolone 4-Benzylsulfanyl-2,2-dimethyl-1,3-thiazol-5-one 4-Benzylsulfanyl-2,2-dimethyl-thiazol-5-one 2,2-Dimethyl-4-(phenylmethylsulfanyl)-1,3-thiazol-5-one
Wiley ID 1254358