| SpectraBase Spectrum ID |
1AMqrdSmOLU |
| Name |
Proglumetacin-M/artifact (HOOC-) ME MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-260.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C13H13NO4/c1-18-12(16)8-7-11(9-15)14-13(17)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3/p+1 |
| InChIKey |
NCDMXQPJAXRGBA-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C([C+]=O)CCC(=O)OC)C(=O)C=1C=CC=CC1 |
| 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 |
