For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5,7-Dimethyl-3-sulfanyl-1,2,4a,5,7,7a-hexahydro-6H-imidazo[4,5-E][1,2,4]triazin-6-one
SpectraBase Compound ID BJiEwI7TtyI
InChI InChI=1S/C6H11N5OS/c1-10-3-4(11(2)6(10)12)8-9-5(13)7-3/h3-4,8H,1-2H3,(H2,7,9,13)
InChIKey WSVWXILNLFZWRU-UHFFFAOYSA-N
Mol Weight 201.25 g/mol
Molecular Formula C6H11N5OS
Exact Mass 201.068431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8xz37KYfCkX
Name 5,7-Dimethyl-3-sulfanyl-1,2,4a,5,7,7a-hexahydro-6H-imidazo[4,5-E][1,2,4]triazin-6-one
CAS Registry Number 296881-68-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11N5OS
InChI InChI=1S/C6H11N5OS/c1-10-3-4(11(2)6(10)12)8-9-5(13)7-3/h3-4,8H,1-2H3,(H2,7,9,13)
InChIKey WSVWXILNLFZWRU-UHFFFAOYSA-N
Molecular Weight 201.248 g/mol
SMILES N1NC2N(C(N(C)C2N=C1S)=O)C
SPLASH splash10-03dl-9500000000-d840e1e7db80d6082f91
Source of Spectrum AD-0-2532-0
Synonyms 5,7-Dimethyl-3-sulfanylidene-2,4,4a,7a-tetrahydro-1H-imidazo[4,5-e][1,2,4]triazin-6-one 5,7-Dimethyl-3-thioxo-2,4,4a,7a-tetrahydro-1H-imidazo[4,5-e][1,2,4]triazin-6-one Propanoic acid, 3,3,3-trifluoro-2-[(3-trifluoromethyl-2-quinoxalinyl)amino]-2-[(4-methoxybenzoyl)amino]-, ethyle ester
Wiley ID 1428120