Saccharin

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Systematic / IUPAC Name: 1,1-Dioxo-1,2-benzothiazol-3-one

ID: Reference2845

Other Names: o-Benzoic acid sulfimide;
o-Benzoic sulfimide;
o-Benzoic sulphimide;
o-Benzosulfimide;
o-Benzosulphimide ; more

Formula: C7H5NO3S

Class: Therapeutics/Prescription Drugs Extractables/Leachables Excipients/Additives/Colorants Personal Care Products/Cosmetics Textile Chemicals/Auxiliary/Dyes Industrial Chemicals

Spectral Data

Saccharin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/29/2018 10:07:53 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)
InChI Key CVHZOJJKTDOEJC-UHFFFAOYSA-N
Canonical SMILES C1=CC=C2C(=C1)C(=O)NS2(=O)=O
CAS 81072
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Other Names o-Benzoic acid sulfimide;
o-Benzoic sulfimide;
o-Benzoic sulphimide;
o-Benzosulfimide;
o-Benzosulphimide;
o-Sulfobenzimide;
o-Sulfobenzoic acid imide;
2-Sulfobenzoic acid imide;
2-Sulfobenzoic imide;
2-Sulphobenzoic imide;
Anhydro-o-sulfaminebenzoic acid;
Benzo-2-sulphimide;
Benzoic acid sulfimide;
Benzoic sulfimide;
Benzoic sulphimide;
Benzosulfimide;
Benzosulfimide, o-;
Benzosulfinide;
Benzosulphimide;
Benzo-sulphinide;
Garantose;
Glucid;
Gluside;
Hermesetas;
Kandiset;
Natreen;
Sacarina;
Saccharimide;
Saccharin acid;
Saccharine;
Saccharinol;
Saccharinose;
Saccharol;
Sacharin;
Saxin;
Sucrette;
Sulfobenzimide, o-;
Sykose;
Syncal;
Zaharina;
o-Benzoyl sulfimide;
o-Benzoyl sulphimide;
1,1-Diox-1,2-benzisothiazol-3-one;
1,1-Dioxide-1,2-benzisothiazol-3(2H)-one;
1,1-Dioxide-1,2-benzisothiazolin-3-one;
1,1-Dioxido-3-oxo-2,3-dihydrobenzo[d]isothiazole;
1,1-Dioxo-1,2-dihydro-benzo[d]isothiazol-3-one;
1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide;
1,2-Benzisothiazolin-3-one 1,1-dioxide;
1,2-Benzisothiazolin-3-one, 1,1-dioxide;
1,2-Benzisothiazoline-3-one 1,1-dioxide;
1,2-Benzothiazol-3(2H)-one 1,1-dioxide;
2,3-Dihydro-1,2-benzisothiazol-3-one-1,1-dioxide;
2,3-Dihydro-1,2-benzoisothiazol-3-one-1,1-dioxide;
2,3-Dihydro-3-oxobenzisosulfonazole;
2,3-Dihydro-3-oxobenzisosulphonazole;
2,3-Dihydroxy-1,2-benzisothiazol-3-one-1,1-dioxide;
2-Hydrobenzo[d]isothiazole-1,1,3-trione;
3-Benzisothiazolinone 1,1-dioxide;
3-Hydroxybenzisothiazole S,S-dioxide;
Benzisosulfonazole, 2,3-dihydro-3-oxo-;
Benzo[d]isothiazol-3(2H)-one 1,1-dioxide;
Benzoylsulfonic imide

In Other Databases

KEGG C12284; D01085; C12283
ChEBI CHEBI:32111
Wikipedia Saccharin
ChemIDPlus 000081072; 002478300; 017140248; 068989015; 000128449; 006485343; 090823384; 010332511; 075011631; 088092799
PubChem 5143
ChemSpider 4959
HMDb HMDB29723