SpectraBase Spectrum ID |
4Z2bSpfkZc |
Name |
3-Indolylmethylketone 2TFA |
Classification |
Designer drug precursor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
351.033012064 u |
Formula |
C14H7F6NO3 |
InChI |
InChI=1S/C14H7F6NO3/c1-7(24-12(23)14(18,19)20)9-6-21(11(22)13(15,16)17)10-5-3-2-4-8(9)10/h2-6H,1H2 |
InChIKey |
NEOAMUSRFPHASR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
351.204 g/mol |
Nominal Mass |
351 u |
Quality |
996 |
Retention Index |
2570 |
SMILES |
C=12N(C(C(F)(F)F)=O)C=C(C2=CC=CC1)C(OC(C(F)(F)F)=O)=C |
SPLASH |
splash10-0fr6-5983000000-2a48d2d4cff54c2d2348 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(1-(trifluoroacetyl)-1H-indol-3-yl)ethenyl trifluoroacetate |
Technique |
GC/MS |
Wiley ID |
DD2024_001731 |