| SpectraBase Spectrum ID |
KnWTwL5VGgW |
| Name |
Cyclobenzaprine-M (nor-HO-) isomer 2 MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C19H19NO |
| InChI |
InChI=1S/C19H19NO/c1-20-12-4-7-18-17-6-3-2-5-14(17)8-9-15-10-11-16(21)13-19(15)18/h2-3,5-11,13,20-21H,4,12H2,1H3/b18-7+ |
| InChIKey |
PTFFXHUUCUKLPG-CNHKJKLMSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(CC\C=C\1C2=CC=CC=C2C=CC2=C1C=C(C=C2)O)C |
| 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 |
