SpectraBase Spectrum ID |
JElY434iG9I |
Name |
3-Methoxyphenethylamine TFA |
CAS Registry Number |
181514-34-1 |
Classification |
Chemical |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
247.082013117 u |
Formula |
C11H12F3NO2 |
InChI |
InChI=1S/C11H12F3NO2/c1-17-9-4-2-3-8(7-9)5-6-15-10(16)11(12,13)14/h2-4,7H,5-6H2,1H3,(H,15,16) |
InChIKey |
JHEXQQMMXISZMO-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
247.217 g/mol |
Nominal Mass |
247 u |
Quality |
992 |
Retention Index |
1523 |
SMILES |
C(NCCC=1C=C(C=CC1)OC)(C(F)(F)F)=O |
SPLASH |
splash10-001i-5910000000-4ebb556367e063fbc4a8 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2,2,2-Trifluoro-N-[2-(3-methoxyphenyl)ethyl]acetamide
N-[2-(3-Methoxyphenyl)ethyl]-2,2,2-trifluoroacetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_006715 |