SpectraBase Spectrum ID |
ECzeUTWqWim |
Name |
3-O-Methyl-dopamine PFP |
Classification |
Biomolecule |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
313.073734062 u |
Formula |
C12H12NO3F5 |
InChI |
InChI=1S/C12H12F5NO3/c1-21-9-6-7(2-3-8(9)19)4-5-18-10(20)11(13,14)12(15,16)17/h2-3,6,19H,4-5H2,1H3,(H,18,20) |
InChIKey |
ILXVOBORMXKATN-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
313.224 g/mol |
SMILES |
c1(cc(OC)c(O)cc1)CCNC(C(F)(F)C(F)(F)F)=O |
SPLASH |
splash10-0f79-2901000000-19e97d92b42405eaae59 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_10543 |