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(S)-1-Fluoro-3-(pyridin-2-yl)propan-2-ol
SpectraBase Compound ID 3AF8ZUzcLcG
InChI InChI=1S/C8H10FNO/c9-6-8(11)5-7-3-1-2-4-10-7/h1-4,8,11H,5-6H2/t8-/m0/s1
InChIKey GOFKESHEQKUDGB-QMMMGPOBSA-N
Mol Weight 155.17 g/mol
Molecular Formula C8H10FNO
Exact Mass 155.074642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wfNkPxk0yU
Name (S)-1-Fluoro-3-(pyridin-2-yl)propan-2-ol
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10FNO
InChI InChI=1S/C8H10FNO/c9-6-8(11)5-7-3-1-2-4-10-7/h1-4,8,11H,5-6H2/t8-/m0/s1
InChIKey GOFKESHEQKUDGB-QMMMGPOBSA-N
Instrument Name Finnigan MAT 95 XP
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202100392
Molecular Weight 155.172 g/mol
Optical Rotation [a]D28 = -17.17 (598 nm) (c = 1.0, CHCl3)
Reported Formula C8H10FNO
SMILES O[C@@](Cc1ccccn1)(CF)[H]
SPLASH splash10-0006-9000000000-f125e1266af02e6f411e
Sample Comments 95% ee
Source of Spectrum CBC-22-SM12-3f
Wiley ID 1865339