| SpectraBase Spectrum ID |
I4yjEkfZrUZ |
| Name |
Efavirenz-M (di-HO-glucuronide) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C14H9ClF3NO4/c15-8-5-9-11(10(20)6-8)19(22)12(21)23-13(9,14(16,17)18)4-3-7-1-2-7/h5-7,20,22H,1-2H2 |
| InChIKey |
AYMANDZHGXLRTB-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
ON1C2=C(C=C(C=C2O)Cl)C(OC1=O)(C(F)(F)F)C#CC1CC1 |
| 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 |
