| SpectraBase Spectrum ID |
5A22BnpwSye |
| Name |
Cyclobenzaprine-M (N-oxide) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 292.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C20H22NO |
| InChI |
InChI=1S/C20H22NO/c1-21(2,22)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-14,22H,7,15H2,1-2H3 |
| InChIKey |
DCOGHGLVWVDAJI-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1=CC2=C(C(C=3C1=CC=CC3)=CCC[N](C)(C)[O])C=CC=C2 |
| 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 |
