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(R)-Ethyl 3,3,3-trifluoro-2-hydroxy-2-(7-ethyl-indol-3-yl)propanoate
SpectraBase Compound ID 4e7l4Yp3yds
InChI InChI=1S/C15H16F3NO3/c1-3-9-6-5-7-10-11(8-19-12(9)10)14(21,15(16,17)18)13(20)22-4-2/h5-8,19,21H,3-4H2,1-2H3/t14-/m1/s1
InChIKey LRHIWHISHULTOF-CQSZACIVSA-N
Mol Weight 315.29 g/mol
Molecular Formula C15H16F3NO3
Exact Mass 315.108228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiBkXfDqyV7
Name (R)-Ethyl 3,3,3-trifluoro-2-hydroxy-2-(7-ethyl-indol-3-yl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16F3NO3
InChI InChI=1S/C15H16F3NO3/c1-3-9-6-5-7-10-11(8-19-12(9)10)14(21,15(16,17)18)13(20)22-4-2/h5-8,19,21H,3-4H2,1-2H3/t14-/m1/s1
InChIKey LRHIWHISHULTOF-CQSZACIVSA-N
Literature Reference DOI 10.1002/asia.201200063
Molecular Weight 315.292 g/mol
SMILES [nH]1cc([C@](O)(C(F)(F)F)C(=O)OCC)c2c1c(ccc2)CC
SPLASH splash10-00sm-0920000000-8bdf8b15236e8543d0d3
Source of Spectrum CAJ-7-1195/SM11-9l
Synonyms (R)-ethyl 2-(7-ethyl-1H-indol-3-yl)-3,3,3-trifluoro-2-hydroxypropanoate
Wiley ID 1773252