| SpectraBase Spectrum ID |
2A435FrTC8b |
| Name |
2C-P-M (oxo-HO-N-acetyl-) isomer 2 MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 296.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H21NO5 |
| InChI |
InChI=1S/C15H21NO5/c1-10(18)16-5-4-11-7-15(21-3)12(6-13(19)9-17)8-14(11)20-2/h7-8,17H,4-6,9H2,1-3H3,(H,16,18) |
| InChIKey |
RQVWPUVNOLBZOZ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(=O)C)CCC1=CC(=C(CC(CO)=O)C=C1OC)OC |
| 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 |
