| SpectraBase Spectrum ID |
JSfyApLBzSq |
| Name |
Metolazone artifact 2ME |
| Classification |
Diuretic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
391.075740323 u |
| Formula |
C18H18ClN3O3S |
| InChI |
InChI=1S/C18H18ClN3O3S/c1-11-7-5-6-8-16(11)22-12(2)20-15-10-14(19)17(9-13(15)18(22)23)26(24,25)21(3)4/h5-10,20H,2H2,1,3-4H3 |
| InChIKey |
CEXQPDXSWUITKX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
391.873 g/mol |
| Related CAS Registry Number(s) |
17560-51-9 |
| SMILES |
c1(ccccc1C)N1C(Nc2cc(c(S(=O)(=O)N(C)C)cc2C1=O)Cl)=C |
| SPLASH |
splash10-004l-1249000000-01c53c58062d190ff344 |
| 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_3110 |
