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

*Links on SpectraBase are not permalinks.
4-tert-Butyl-3-chloro-1-methyl-.delta.(2)-1,2,4-triazolin-5-one
SpectraBase Compound ID 51dJtWu0TNf
InChI InChI=1S/C7H12ClN3O/c1-7(2,3)11-5(8)9-10(4)6(11)12/h1-4H3
InChIKey FHCVEUZEVKHEBN-UHFFFAOYSA-N
Mol Weight 189.65 g/mol
Molecular Formula C7H12ClN3O
Exact Mass 189.06689 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 J6fdqqZ8L2e
Name 4-tert-Butyl-3-chloro-1-methyl-.delta.(2)-1,2,4-triazolin-5-one
CAS Registry Number 118631-38-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12ClN3O
InChI InChI=1S/C7H12ClN3O/c1-7(2,3)11-5(8)9-10(4)6(11)12/h1-4H3
InChIKey FHCVEUZEVKHEBN-UHFFFAOYSA-N
Molecular Weight 189.646 g/mol
SMILES C=1(N(C(N(N1)C)=O)C(C)(C)C)Cl
SPLASH splash10-0a59-6900000000-3c9c73c8d8479e651e82
Source of Spectrum J-54-1050-15
Synonyms 4-tert-Butyl-5-chloro-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one 4-tert-Butyl-5-chloranyl-2-methyl-1,2,4-triazol-3-one
Wiley ID 1185420