| SpectraBase Spectrum ID |
7y2oph5gKdE |
| Name |
5-F-PB-22 MS2 |
| CAS Registry Number |
1400742-41-7 |
| Comments |
F: ITMS + c ESI d w Full ms2 377.20 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C23H21FN2O2 |
| InChI |
InChI=1S/C23H21FN2O2/c24-13-4-1-5-15-26-16-19(18-10-2-3-11-20(18)26)23(27)28-21-12-6-8-17-9-7-14-25-22(17)21/h2-3,6-12,14,16H,1,4-5,13,15H2 |
| InChIKey |
MBOCMBFDYVSGLJ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1=C2C(=CC=C1)N(C=C2C(OC1=C2C(=CC=C1)C=CC=N2)=O)CCCCCF |
| 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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
