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

*Links on SpectraBase are not permalinks.
5,5-Dimethyl-2-nitro-5,6-dihydro-1,3-benzothiazol-7(4H)-one
SpectraBase Compound ID BjDWHMxCv5y
InChI InChI=1S/C9H10N2O3S/c1-9(2)3-5-7(6(12)4-9)15-8(10-5)11(13)14/h3-4H2,1-2H3
InChIKey VVBRQKGCTQVXEH-UHFFFAOYSA-N
Mol Weight 226.25 g/mol
Molecular Formula C9H10N2O3S
Exact Mass 226.041213 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 vFysSBu2Ah
Name 5,5-Dimethyl-2-nitro-5,6-dihydro-1,3-benzothiazol-7(4H)-one
Alternate Name(s) 5,5-Dimethyl-2-nitro-4,6-dihydro-1,3-benzothiazol-7-one Benzothiazol-7(6H)-one, 4,5-dihydroxy-5,5-dimethyl-2-nitro-
CAS Registry Number 340968-34-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O3S
InChI InChI=1S/C9H10N2O3S/c1-9(2)3-5-7(6(12)4-9)15-8(10-5)11(13)14/h3-4H2,1-2H3
InChIKey VVBRQKGCTQVXEH-UHFFFAOYSA-N
Molecular Weight 226.250 g/mol
SMILES c1(sc2C(CC(Cc2n1)(C)C)=O)N(=O)=O
SPLASH splash10-0007-7900000000-ab78ca02cd080dcee93f
Source of Spectrum AD-0-2532-0
Wiley ID 1425171