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3-Methyl-5-phenyl-1,3,4-thiadiazole-2(3H)-thione
SpectraBase Compound ID nnfetIoI4G
InChI InChI=1S/C9H8N2S2/c1-11-9(12)13-8(10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey XFXHZWGGDQXLQO-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C9H8N2S2
Exact Mass 208.012891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArJ1q2FjaZW
Name 1,3,4-Thiadiazole-2(3H)-thione, 3-methyl-5-phenyl-
Alternate Name(s) 3-Methyl-5-phenyl-1,3,4-thiadiazole-2(3H)-thione 3-Methyl-5-phenyl-1,3,4-thiadiazole-2-thione
CAS Registry Number 5770-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2S2
InChI InChI=1S/C9H8N2S2/c1-11-9(12)13-8(10-11)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey XFXHZWGGDQXLQO-UHFFFAOYSA-N
Molecular Weight 208.297 g/mol
SMILES C1(SC(=NN1C)c1ccccc1)=S
SPLASH splash10-0a4i-8890000000-7ebbabbeafc37ad760db
Source of Spectrum H-63-657-11
Wiley ID 1206293