| SpectraBase Spectrum ID |
1y7bBfeE8e |
| Name |
Dapsone |
| CAS Registry Number |
80-08-0 |
| Classification |
Pharmaceutical drug, antileprotic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
248.061948806 u |
| Formula |
C12H12N2O2S |
| InChI |
InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2 |
| InChIKey |
MQJKPEGWNLWLTK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
248.300 g/mol |
| Nominal Mass |
248 u |
| Quality |
899 |
| Retention Index |
2880 |
| SMILES |
NC=1C=CC(S(C=2C=CC(=CC2)N)(=O)=O)=CC1 |
| SPLASH |
splash10-0005-5960000000-fbd1895c6d9d7803cc1b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bis(4-aminophenyl)sulphone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007875 |
