| SpectraBase Spectrum ID |
YDKBZClS3K |
| Name |
Tienylic acid ME |
| Classification |
Diuretic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
343.967685372 u |
| Formula |
C14H10O4Cl2S |
| InChI |
InChI=1S/C14H10Cl2O4S/c1-19-11(17)7-20-9-5-4-8(12(15)13(9)16)14(18)10-3-2-6-21-10/h2-6H,7H2,1H3 |
| InChIKey |
OKJCGROSLHFAEH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
345.196 g/mol |
| Related CAS Registry Number(s) |
40180-04-9 |
| SMILES |
COC(COc1c(Cl)c(Cl)c(cc1)C(c1sccc1)=O)=O |
| SPLASH |
splash10-03di-3932000000-a8af6a1730af506be37e |
| 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_7421 |
