| SpectraBase Spectrum ID |
3hdjkY4AOxI |
| Name |
PCMPA-M (O-demethyl-HO-ring) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 250.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H23NO2 |
| InChI |
InChI=1S/C15H23NO2/c17-12-4-11-16-15(9-7-14(18)8-10-15)13-5-2-1-3-6-13/h1-3,5-6,14,16-18H,4,7-12H2 |
| InChIKey |
VOXMJHPMVAMCBA-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C1(CCC(CC1)O)C=1C=CC=CC1)CCCO |
| 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 |
