| SpectraBase Spectrum ID |
HtPwyceyrWF |
| Name |
Diltiazem-M (deacetyl-N-demethyl-) MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-220.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C10H12N2OS/c1-11-6-7-12(8-13)9-4-2-3-5-10(9)14/h2-5,11H,6-7H2,1H3/p+1 |
| InChIKey |
BRIQXOPLUWVTBM-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(CCN(C1=C(C=CC=C1)S)[C+]=O)C |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
