| SpectraBase Spectrum ID |
8FIf0KvCvnE |
| Name |
Chlorthalidone 4ME |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
394.075405970 u |
| Formula |
C18H19ClN2O4S |
| InChI |
InChI=1S/C18H19ClN2O4S/c1-20(2)26(23,24)16-11-12(9-10-15(16)19)18(25-4)14-8-6-5-7-13(14)17(22)21(18)3/h5-11H,1-4H3 |
| InChIKey |
BTVURLRTBZYINY-UHFFFAOYSA-N |
| Ionization Type |
Chemical Ionization (CI) |
| Molecular Weight |
394.873 g/mol |
| Nominal Mass |
394 u |
| Reagent Gas |
Methane |
| Retention Index |
2908 |
| SMILES |
C1(C=2C(C(N1C)=O)=CC=CC2)(C1=CC(S(N(C)C)(=O)=O)=C(C=C1)Cl)OC |
| SPLASH |
splash10-0002-0019100000-0b2697aba529a473c620 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Chloro-5-(1-hydroxy-2-methyl-3-oxo-2,3-dihydro-1H-isoindol-1-yl)-N,N-dimethylbenzene-1-\rsulfonamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000681 |
