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

*Links on SpectraBase are not permalinks.
6,6-Dimethyl-4,5,6,7-tetrahydro-1H-benzotriazol-4-one
SpectraBase Compound ID 7IctSfzlUzi
InChI InChI=1S/C8H11N3O/c1-8(2)3-5-7(6(12)4-8)10-11-9-5/h3-4H2,1-2H3,(H,9,10,11)
InChIKey OIXJNHUOIYKZPK-UHFFFAOYSA-N
Mol Weight 165.2 g/mol
Molecular Formula C8H11N3O
Exact Mass 165.090212 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 HM8IXasIvGs
Name 6,6-Dimethyl-4,5,6,7-tetrahydro-1H-benzotriazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11N3O
InChI InChI=1S/C8H11N3O/c1-8(2)3-5-7(6(12)4-8)10-11-9-5/h3-4H2,1-2H3,(H,9,10,11)
InChIKey OIXJNHUOIYKZPK-UHFFFAOYSA-N
Molecular Weight 165.196 g/mol
SMILES [nH]1nnc2c1CC(CC2=O)(C)C
SPLASH splash10-0a4i-1900000000-b17ff224e417b1821b44
Source of Spectrum J-58-7083-4
Synonyms 6,6-Dimethyl-1,5,6,7-tetrahydro-4H-1,2,3-benzotriazol-4-one
Wiley ID 1161316