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2-Methylamino-4-(4-chlorophenyl)-1,3,4-thiadiazolin-5-one
SpectraBase Compound ID 5xDDhdPej1t
InChI InChI=1S/C9H8ClN3OS/c1-11-8-12-13(9(14)15-8)7-4-2-6(10)3-5-7/h2-5H,1H3,(H,11,12)
InChIKey FXBMFQYNJDFYFE-UHFFFAOYSA-N
Mol Weight 241.7 g/mol
Molecular Formula C9H8ClN3OS
Exact Mass 241.007661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHgzkNqwqHC
Name 2-Methylamino-4-(4-chlorophenyl)-1,3,4-thiadiazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClN3OS
InChI InChI=1S/C9H8ClN3OS/c1-11-8-12-13(9(14)15-8)7-4-2-6(10)3-5-7/h2-5H,1H3,(H,11,12)
InChIKey FXBMFQYNJDFYFE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100036
Molecular Weight 241.696 g/mol
SMILES N(C=1SC(N(N1)c1ccc(cc1)Cl)=O)C
SPLASH splash10-002f-0790000000-a79ff36582d638309cfa
Source of Spectrum QA-48-224-6f
Synonyms 3-(4-Chlorophenyl)-5-(methylamino)-1,3,4-thiadiazol-2(3H)-one
Wiley ID 1795307