SpectraBase Spectrum ID |
JwLVfDlQJhx |
Name |
3-O-Methyl-dopamine 2TFA |
Classification |
Biomolecule |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
359.059226812 u |
Formula |
C13H11NO4F6 |
InChI |
InChI=1S/C13H11F6NO4/c1-23-9-6-7(4-5-20-10(21)12(14,15)16)2-3-8(9)24-11(22)13(17,18)19/h2-3,6H,4-5H2,1H3,(H,20,21) |
InChIKey |
BCNUYVIWUMREID-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
359.224 g/mol |
SMILES |
c1(cc(OC)c(OC(C(F)(F)F)=O)cc1)CCNC(C(F)(F)F)=O |
SPLASH |
splash10-0002-7790000000-5553a3e338862d155982 |
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_10542 |