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2-Ethyl-7-(methylsulfanyl)-5H-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazin-5-one
SpectraBase Compound ID DThXOjES3kb
InChI InChI=1S/C7H8N4OS2/c1-3-4-10-11-6(12)8-5(13-2)9-7(11)14-4/h3H2,1-2H3
InChIKey ZAPMMTSMAZQZGF-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C7H8N4OS2
Exact Mass 228.013953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kw9iQi3psAp
Name 2-Ethyl-7-(methylsulfanyl)-5H-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazin-5-one
CAS Registry Number 58326-42-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N4OS2
InChI InChI=1S/C7H8N4OS2/c1-3-4-10-11-6(12)8-5(13-2)9-7(11)14-4/h3H2,1-2H3
InChIKey ZAPMMTSMAZQZGF-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES C1=2N(C(=O)N=C(N2)SC)N=C(S1)CC
SPLASH splash10-03fr-2490000000-3f30411245b9ac496b16
Source of Spectrum O-24-382-8
Synonyms 2-Ethyl-7-(methylthio)-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazin-5-one 2-Ethyl-7-methylsulfanyl-[1,3,4]thiadiazolo[3,2-a][1,3,5]triazin-5-one 2-Ethyl-7-methylthio-1,3,4-thiadiazolo[3,2-a](1,3,5)triazine-5-one
Wiley ID 1229019