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(R)-4-(2,2,2-Trifluoro-1-hydroxy-1-(1H-pyrrol-2-yl)ehyl)benzonitrile

View entire compound with spectra: 1 MS (GC)

(R)-4-(2,2,2-Trifluoro-1-hydroxy-1-(1H-pyrrol-2-yl)ehyl)benzonitrile
SpectraBase Compound ID 7TUlyx5CFz2
InChI InChI=1S/C13H9F3N2O/c14-13(15,16)12(19,11-2-1-7-18-11)10-5-3-9(8-17)4-6-10/h1-7,18-19H/t12-/m1/s1
InChIKey KPQNBPSWPKSONN-GFCCVEGCSA-N
Mol Weight 266.22 g/mol
Molecular Formula C13H9F3N2O
Exact Mass 266.066697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2U2u6O2Xia
Name (R)-4-(2,2,2-Trifluoro-1-hydroxy-1-(1H-pyrrol-2-yl)ehyl)benzonitrile
Alternate Name(s) (R)-4-(2,2,2-trifluoro-1-hydroxy-1-(1H-pyrrol-2-yl)ethyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F3N2O
InChI InChI=1S/C13H9F3N2O/c14-13(15,16)12(19,11-2-1-7-18-11)10-5-3-9(8-17)4-6-10/h1-7,18-19H/t12-/m1/s1
InChIKey KPQNBPSWPKSONN-GFCCVEGCSA-N
Literature Reference DOI 10.1021/ol802509m
Molecular Weight 266.223 g/mol
SMILES O[C@](c1[nH]ccc1)(C(F)(F)F)c1ccc(cc1)C#N
SPLASH splash10-0032-0920000000-9fa84847d19d71970761
Source of Spectrum A1-11-441/SMS6-3i
Wiley ID 1756395