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(2S,4R)-1,1,1-Trifluoro-4-{[(1R)-1-phenylethyl]amino}pentan-2-ol
SpectraBase Compound ID A33Fk9kncQa
InChI InChI=1S/C13H18F3NO/c1-9(8-12(18)13(14,15)16)17-10(2)11-6-4-3-5-7-11/h3-7,9-10,12,17-18H,8H2,1-2H3/t9-,10-,12+/m1/s1
InChIKey BZVIXJWGFVRZSZ-FOGDFJRCSA-N
Mol Weight 261.29 g/mol
Molecular Formula C13H18F3NO
Exact Mass 261.134049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SJFIi9Sfg
Name (2S,4R)-1,1,1-Trifluoro-4-{[(1R)-1-phenylethyl]amino}pentan-2-ol
Alternate Name(s) (2S,4R)-1,1,1-trifluoro-4-{[(1R)-1-phenylethyl]amino}-2-pentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18F3NO
InChI InChI=1S/C13H18F3NO/c1-9(8-12(18)13(14,15)16)17-10(2)11-6-4-3-5-7-11/h3-7,9-10,12,17-18H,8H2,1-2H3/t9-,10-,12+/m1/s1
InChIKey BZVIXJWGFVRZSZ-FOGDFJRCSA-N
Molecular Weight 261.288 g/mol
SMILES N([C@@](C[C@@](C(F)(F)F)(O)[H])(C)[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-052b-0890000000-b9563e3179408bce6a2e
Source of Spectrum QC-17-1314-3
Wiley ID 1638269