| SpectraBase Spectrum ID |
CpmF6uxC947 |
| Name |
Tapentadol-M (HO-aryl-glucuronide) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-285.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C14H23NO2 |
| InChI |
InChI=1S/C14H23NO2/c1-5-12(10(2)9-15(3)4)11-6-7-13(16)14(17)8-11/h6-8,10,12,16-17H,5,9H2,1-4H3 |
| InChIKey |
JFFPKOQNCJYHHB-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C=C(C=CC1O)C(C(CN(C)C)C)CC |
| 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 |
ms3 |
| Technique |
ITMS |
