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2-Dimethylamino-4-(4-methylphenyl)-1,3,4-thiadiazolin-5-one
SpectraBase Compound ID 2aO0o3YjggM
InChI InChI=1S/C11H13N3OS/c1-8-4-6-9(7-5-8)14-11(15)16-10(12-14)13(2)3/h4-7H,1-3H3
InChIKey LYRNEORBPWVYRL-UHFFFAOYSA-N
Mol Weight 235.3 g/mol
Molecular Formula C11H13N3OS
Exact Mass 235.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YSiLBgc0Le
Name 2-Dimethylamino-4-(4-methylphenyl)-1,3,4-thiadiazolin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N3OS
InChI InChI=1S/C11H13N3OS/c1-8-4-6-9(7-5-8)14-11(15)16-10(12-14)13(2)3/h4-7H,1-3H3
InChIKey LYRNEORBPWVYRL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100036
Molecular Weight 235.305 g/mol
SMILES C=1(SC(N(N1)c1ccc(cc1)C)=O)N(C)C
SPLASH splash10-000i-5490000000-7734b70f06fb7489d37e
Source of Spectrum QA-48-225-6j
Synonyms 5-(dimethylamino)-3-(p-tolyl)-1,3,4-thiadiazol-2(3H)-one
Wiley ID 1795311