SpectraBase Spectrum ID |
5Z6Nl1EwRMG |
Name |
Sulfamethoxazole |
CAS Registry Number |
723-46-6 |
Classification |
Pharmaceutical drug, antibiotic |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
253.052112397 u |
Formula |
C10H11N3O3S |
InChI |
InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13) |
InChIKey |
JLKIGFTWXXRPMT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
253.276 g/mol |
Nominal Mass |
253 u |
Quality |
992 |
Retention Index |
2043 |
SMILES |
NC=1C=CC(S(NC=2C=C(ON2)C)(=O)=O)=CC1 |
SPLASH |
splash10-05mo-9500000000-78549ad178ce2f8b0b98 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
SMX
SMZ
4-Amino-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide |
Technique |
GC/MS |
Wiley ID |
DD2024_003974 |