| SpectraBase Spectrum ID |
6bTwtCZj9FA |
| Name |
Citalopram-M (glucuronide) MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C18H13FN/c1-2-18(15-4-6-16(19)7-5-15)10-9-14-11-13(12-20)3-8-17(14)18/h3-11H,1-2H2/q+1 |
| InChIKey |
HGROZBAUWVWEOV-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1(C2=C(C=C(C#N)C=C2)C=C1)(C1=CC=C(C=C1)F)C[CH2+] |
| 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 |
