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(S)-(-)-1-CYANO-3,3,3-TRIFLUORO-2-PROPANOL
SpectraBase Compound ID 2Bw6gXzpw5k
InChI InChI=1S/C4H4F3NO/c5-4(6,7)3(9)1-2-8/h3,9H,1H2/t3-/m0/s1
InChIKey NCKPCYRKCHNXIW-VKHMYHEASA-N
Mol Weight 139.08 g/mol
Molecular Formula C4H4F3NO
Exact Mass 139.024498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1rPn8LjIKXn
Name (S)-(-)-1-CYANO-3,3,3-TRIFLUORO-2-PROPANOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C4H4F3NO
InChI InChI=1S/C4H4F3NO/c5-4(6,7)3(9)1-2-8/h3,9H,1H2/t3-/m0/s1
InChIKey NCKPCYRKCHNXIW-VKHMYHEASA-N
Literature Reference Author P.V.RAMACHANDRAN,B.GONG,H.C.BROWN
Literature Reference Citation J.ORG.CHEM.,60,41(1995)
Literature Reference DOI 10.1021/jo00106a012
Molecular Weight 139.077 g/mol
Solvent CDCl3:ACETONE-D6
Source File Reference UWRU3184