| SpectraBase Spectrum ID |
3VdUg320wP7 |
| Name |
Metolazone 3ME |
| Classification |
Diuretic |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
407.107040451 u |
| Formula |
C19H22ClN3O3S |
| InChI |
InChI=1S/C19H22ClN3O3S/c1-12-8-6-7-9-16(12)23-13(2)22(5)17-11-15(20)18(10-14(17)19(23)24)27(25,26)21(3)4/h6-11,13H,1-5H3 |
| InChIKey |
VLRRCVPDVPQPQI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
407.916 g/mol |
| Related CAS Registry Number(s) |
17560-51-9 |
| SMILES |
c1(S(=O)(N(C)C)=O)c(cc2c(C(N(C(C)N2C)c2ccccc2C)=O)c1)Cl |
| SPLASH |
splash10-0006-1329000000-e49ae11ba7a42733de5e |
| 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. |
| 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_6891 |
