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(2S)-1,1,1-trifluoro-3-[(phenylmethyl)amino]-2-propanol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(2S)-1,1,1-trifluoro-3-[(phenylmethyl)amino]-2-propanol
SpectraBase Compound ID IohHaS8gsIU
InChI InChI=1S/C10H12F3NO/c11-10(12,13)9(15)7-14-6-8-4-2-1-3-5-8/h1-5,9,14-15H,6-7H2/t9-/m0/s1
InChIKey NKTRJOFXPSASPC-VIFPVBQESA-N
Mol Weight 219.21 g/mol
Molecular Formula C10H12F3NO
Exact Mass 219.087098 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ad9kdryzuyi
Name (2S)-1,1,1-Trifluoro-3-[(phenylmethyl)amino]-2-propanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.087098498 u
Formula C10H12F3NO
InChI InChI=1S/C10H12F3NO/c11-10(12,13)9(15)7-14-6-8-4-2-1-3-5-8/h1-5,9,14-15H,6-7H2/t9-/m0/s1
InChIKey NKTRJOFXPSASPC-VIFPVBQESA-N
Molecular Weight 219.207 g/mol
SMILES C([C@@](O)(CNCC=1C=CC=CC1)[H])(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.843488