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4,5,7-trimethyl-3-thioxooctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one
SpectraBase Compound ID Cps35Zvc54S
InChI InChI=1S/C7H13N5OS/c1-10-4-5(12(3)7(10)13)11(2)6(14)9-8-4/h4-5,8H,1-3H3,(H,9,14)
InChIKey TYFPRPPVBNEGDJ-UHFFFAOYSA-N
Mol Weight 215.28 g/mol
Molecular Formula C7H13N5OS
Exact Mass 215.084081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID cSpnzTzxid
Name 4,5,7-Trimethyl-3-thioxooctahydro-6H-imidazo[4,5-E][1,2,4]triazin-6-one
Alternate Name(s) 4,5,7-trimethyl-3-sulfanylidene-1,2,4a,7a-tetrahydroimidazo[4,5-e][1,2,4]triazin-6-one 4,5,7-trimethyl-3-thioxo-1,2,4a,7a-tetrahydroimidazo[4,5-e][1,2,4]triazin-6-one Imidazo[4,5-E]1,2,4-triazin-6-one, perhydro-4,5,7-trimethyl-3-thioxo-
CAS Registry Number 309742-27-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13N5OS
InChI InChI=1S/C7H13N5OS/c1-10-4-5(12(3)7(10)13)11(2)6(14)9-8-4/h4-5,8H,1-3H3,(H,9,14)
InChIKey TYFPRPPVBNEGDJ-UHFFFAOYSA-N
Molecular Weight 215.275 g/mol
SMILES N1NC2C(N(C)C(N2C)=O)N(C)C1=S
SPLASH splash10-052f-9400000000-c0b7efee62bf8800dd6b
Source of Spectrum AD-0-2532-0
Wiley ID 1431010