| SpectraBase Spectrum ID |
60nzjGeqIot |
| Name |
Carbamazepine-M (10.11-epoxide-HO-ring) MS2 |
| Comments |
T: ITMS + c ESI d w Full ms2 [email protected] [60.00-280.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C15H12N2O3 |
| InChI |
InChI=1S/C15H12N2O3/c16-15(19)17-11-4-2-1-3-9(11)13-14(20-13)10-7-8(18)5-6-12(10)17/h1-7,13-14,18H,(H2,16,19) |
| InChIKey |
NYFKJANLMLVARE-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NC(N1C=2C(C3C(C4=C1C=CC(=C4)O)O3)=CC=CC2)=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 |
