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2-Trifluoromethyl-3-[3-indolyl]propionic acid
SpectraBase Compound ID H2NJznWvm8e
InChI InChI=1S/C12H10F3NO2/c13-12(14,15)9(5-11(17)18)8-6-16-10-4-2-1-3-7(8)10/h1-4,6,9,16H,5H2,(H,17,18)
InChIKey RJIJUJRAERDEMV-UHFFFAOYSA-N
Mol Weight 257.21 g/mol
Molecular Formula C12H10F3NO2
Exact Mass 257.066363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pY8FYzhrc
Name 2-Trifluoromethyl-3-[3-indolyl]propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F3NO2
InChI InChI=1S/C12H10F3NO2/c13-12(14,15)9(5-11(17)18)8-6-16-10-4-2-1-3-7(8)10/h1-4,6,9,16H,5H2,(H,17,18)
InChIKey RJIJUJRAERDEMV-UHFFFAOYSA-N
Molecular Weight 257.212 g/mol
SMILES OC(CC(c1c[nH]c2c1cccc2)C(F)(F)F)=O
SPLASH splash10-052k-0890000000-7bc4817f365c9277c747
Source of Spectrum F-56-2660-14
Synonyms 4,4,4-Trifluoro-3-(1H-indol-3-yl)butanoic acid 4,4,4-trifluoro-3-(1H-indol-3-yl)butyric acid 4,4,4-tris(fluoranyl)-3-(1H-indol-3-yl)butanoic acid
Wiley ID 856574