| SpectraBase Spectrum ID |
KhFJLJs746b |
| Name |
Piretanide 3ME |
| Classification |
Diuretic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
404.140593050 u |
| Formula |
C20H24N2O5S |
| InChI |
InChI=1S/C20H24N2O5S/c1-21(2)28(24,25)18-14-15(20(23)26-3)13-17(22-11-7-8-12-22)19(18)27-16-9-5-4-6-10-16/h4-6,9-10,13-14H,7-8,11-12H2,1-3H3 |
| InChIKey |
JLYNDJGRHUBDOF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
404.481 g/mol |
| SMILES |
c1(ccccc1)Oc1c(cc(cc1N1CCCC1)C(OC)=O)S(=O)(=O)N(C)C |
| SPLASH |
splash10-0002-4690100000-e29440f2fff8409a16ef |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: UME |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3101 |
