SpectraBase Spectrum ID |
B34UABWwqrA |
Name |
5-Methyl-1H-indole-3-ethanol 2TFA |
Classification |
Pharmaceutical drug precursor derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
367.064312193 u |
Formula |
C15H11F6NO3 |
InChI |
InChI=1S/C15H11F6NO3/c1-8-2-3-11-10(6-8)9(4-5-25-13(24)15(19,20)21)7-22(11)12(23)14(16,17)18/h2-3,6-7H,4-5H2,1H3 |
InChIKey |
BCYLURMHZXWYSK-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
367.247 g/mol |
Nominal Mass |
367 u |
Quality |
983 |
Retention Index |
1708 |
SMILES |
C=12N(C=C(C2=CC(=CC1)C)CCOC(C(F)(F)F)=O)C(C(F)(F)F)=O |
SPLASH |
splash10-0f6x-1972000000-db4f515b69e7daae1c13 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5-Methylindole-3-ethanol 2TFA
2-(5-methyl-1-(trifluoroacetyl)-1H-indol-3-yl)ethyl trifluoroacetate |
Technique |
GC/MS |
Wiley ID |
DD2024_015866 |