| SpectraBase Spectrum ID |
K7XJwPBUPiv |
| Name |
5-F-MDMB-PINACA-M (HOOC-defluoro-HO-) MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-245.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C13H15N3O/c1-2-3-6-9-16-11-8-5-4-7-10(11)12(15-16)13(14)17/h2,4-5,7-8H,1,3,6,9H2,(H2,14,17)/p+1 |
| InChIKey |
IYEWGMXPLWFOCY-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[NH+]=1N(C2=CC=CC=C2C1C(N)=O)CCCC=C |
| 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 |
