Systematic / IUPAC Name: 1,3-Benzothiazol-2(3H)-one
ID: Reference3040
Other Names:
(2-Mercatophenyl)carbamothioic acid γ-lactone;
S-Orthophenylenethiocarbamate;
2(3H)-Benzothiazolone;
2,3-Dihydro-1,3-benzothiazol-2-one;
2-Benzothiazolinone
; more
Formula: C7H5NOS
Class: Endogenous Metabolites Personal Care Products/Cosmetics Natural Products/Medicines
2-Hydroxybenzothiazole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Plus Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 134 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 9/25/2015 12:08:40 PM |
InChI | InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9) |
InChI Key | YEDUAINPPJYDJZ-UHFFFAOYSA-N |
Canonical SMILES | C1=CC=C2C(=C1)NC(=O)S2 |
CAS | 934349 |
Splash | |
Other Names |
(2-Mercatophenyl)carbamothioic acid γ-lactone; S-Orthophenylenethiocarbamate; 2(3H)-Benzothiazolone; 2,3-Dihydro-1,3-benzothiazol-2-one; 2-Benzothiazolinone; 2-Benzothiazolone; 2-Hydroxy-1,3-benzothiazole; 2-Oxobenzothiazole; 3H-1,3-Benzothiazol-2-one; 3H-Benzothiazol-2-one; 3-Hydrobenzothiazol-2-one; Benzo[d]thiazol-2(3H)-one; Benzo[d]thiazol-2-ol; Benzothiazol, 2-hydroxy-; Benzothiazol-2(3H)-one; Benzothiazol-2-ol; Benzothiazolol; Benzothiazolone; Benzthiazoline,2-one; Carbamothioic acid, (2-mercatophenyl)-, γ-lactone; Hydroxybenzothiazole; HBT |
ChemIDPlus | 000934349 |
PubChem | 13625 |
ChemSpider | 13036 |
ChEBI | CHEBI:115196 |