| SpectraBase Spectrum ID |
5pUj5YrVQW |
| Name |
RCS-08-M (O-demethyl-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 362.30 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C24H27NO2 |
| InChI |
InChI=1S/C24H27NO2/c26-23-13-7-4-10-19(23)16-24(27)21-17-25(22-12-6-5-11-20(21)22)15-14-18-8-2-1-3-9-18/h4-7,10-13,17-18,26H,1-3,8-9,14-16H2 |
| InChIKey |
ZPCRBDGMUJFSGN-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C(CC(C=2C3=C(N(CCC4CCCCC4)C2)C=CC=C3)=O)=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 |
ms2 |
| Technique |
ITMS |
