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1,1,1-trifluoro-3-[2-methyl-1-(2,2,2-trifluoroacetyl)-1H-indol-3-yl]propan-2-one
SpectraBase Compound ID WS9hjCKpu
InChI InChI=1S/C14H9F6NO2/c1-7-9(6-11(22)13(15,16)17)8-4-2-3-5-10(8)21(7)12(23)14(18,19)20/h2-5H,6H2,1H3
InChIKey UGCPGBGAFGNETD-UHFFFAOYSA-N
Mol Weight 337.22 g/mol
Molecular Formula C14H9F6NO2
Exact Mass 337.053748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IX7XXgIJJpa
Name 1,1,1-trifluoro-3-[2-methyl-1-(2,2,2-trifluoroacetyl)-1H-indol-3-yl]propan-2-one
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.053747510 u
Formula C14H9F6NO2
GC Column RTX-1 (105 m x 0.25 mm, film thickness 0.5 micrometer)
GC Oven Program Oven temp 320 oC
InChI InChI=1S/C14H9F6NO2/c1-7-9(6-11(22)13(15,16)17)8-4-2-3-5-10(8)21(7)12(23)14(18,19)20/h2-5H,6H2,1H3
InChIKey UGCPGBGAFGNETD-UHFFFAOYSA-N
Instrument Name MS-80
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240170608
Molecular Weight 337.221 g/mol
Quality 340
SMILES C1=CC2=C(N(C(C(F)(F)F)=O)C(C)=C2CC(=O)C(F)(F)F)C=C1
SPLASH splash10-0006-3690000000-064c8c8f0e7bf04caf7e
Source of Spectrum HRC-17-423-Figure 5d (DOI: 10.1002/jhrc.1240170608)
Wiley ID 1910849