| SpectraBase Spectrum ID |
8A4LqliZwO |
| Name |
Ranitidine-M (N-oxide) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 331.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C13H23N4O4S |
| InChI |
InChI=1S/C13H23N4O4S/c1-14-13(8-16(18)19)15-6-7-22-10-12-5-4-11(21-12)9-17(2,3)20/h4-5,8,14-15,20H,6-7,9-10H2,1-3H3/q+1/b13-8+ |
| InChIKey |
ZFMVTFYZBAZIAS-MDWZMJQESA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
O[N+](CC1=CC=C(CSCCN\C(=C\N(=O)=O)NC)O1)(C)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 |
ms2 |
| Technique |
ITMS |
