| SpectraBase Spectrum ID |
6UGuflvNlw |
| Name |
Ampicillin-M (ampicilloic acid) MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C15H18N2O3S/c1-15(2,10-12(18)19)21-9-8-17-14(20)13(16)11-6-4-3-5-7-11/h3-10,13H,16H2,1-2H3,(H-,17,18,19,20)/p+1/b9-8+ |
| InChIKey |
RGCAAWMIEYPTDQ-CMDGGOBGSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC([CH+]C(S\C=C\NC(C(C1=CC=CC=C1)N)=O)(C)C)=O |
| 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 |
