| SpectraBase Spectrum ID |
FrCs2PQvygX |
| Name |
JWH-250-M (O-demethyl-HO-ring) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 338.25 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C21H23NO3 |
| InChI |
InChI=1S/C21H23NO3/c1-2-3-6-12-22-14-17(16-9-4-5-10-18(16)22)20(24)13-15-8-7-11-19(23)21(15)25/h4-5,7-11,14,23,25H,2-3,6,12-13H2,1H3 |
| InChIKey |
DGPSYTYHIBSXJR-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1=C(C=CC=C1CC(C=1C=2C=CC=CC2N(C1)CCCCC)=O)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 |
ms2 |
| Technique |
ITMS |
