| SpectraBase Spectrum ID |
4tm8H6ADH7V |
| Name |
Piretanide (ME)AC |
| Classification |
Diuretic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
418.119857604 u |
| Formula |
C20H22N2O6S |
| InChI |
InChI=1S/C20H22N2O6S/c1-14(23)21-29(25,26)18-13-15(20(24)27-2)12-17(22-10-6-7-11-22)19(18)28-16-8-4-3-5-9-16/h3-5,8-9,12-13H,6-7,10-11H2,1-2H3,(H,21,23) |
| InChIKey |
QQYVWHWQVCAKAJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
418.464 g/mol |
| Related CAS Registry Number(s) |
55837-27-9 |
| SMILES |
c1ccccc1Oc1c(S(=O)(=O)NC(C)=O)cc(C(OC)=O)cc1N1CCCC1 |
| SPLASH |
splash10-014j-1391100000-b4d84a42124c150e2e97 |
| 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: U+UHYAC |
| 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_6412 |
