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5-Methyl-1H-indole-3-ethanol 2TFA
SpectraBase Compound ID 2g90ciiCxFB
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
Mol Weight 367.25 g/mol
Molecular Formula C15H11F6NO3
Exact Mass 367.064312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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