| SpectraBase Spectrum ID |
I3sdwAE8ty4 |
| Name |
DFBDB-M (N-oxide) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-225.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C11H11F2O2/c1-2-3-5-8-6-4-7-9-10(8)15-11(12,13)14-9/h3-4,6-7H,2,5H2,1H3/q+1 |
| InChIKey |
BPFACATULPAQCV-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH+](CC1=CC=CC2=C1OC(O2)(F)F)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 |
