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(S)-(-)-1-chloro-3-(4-fluorophenoxy)-2-propanol
SpectraBase Compound ID LKvflE3WfTN
InChI InChI=1S/C9H10ClFO2/c10-5-8(12)6-13-9-3-1-7(11)2-4-9/h1-4,8,12H,5-6H2/t8-/m1/s1
InChIKey OSIKOYZBGUHWAB-MRVPVSSYSA-N
Mol Weight 204.63 g/mol
Molecular Formula C9H10ClFO2
Exact Mass 204.035335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9DM9CTRpYdS
Name (S)-(-)-1-chloro-3-(4-fluorophenoxy)-2-propanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.035335423 u
Formula C9H10ClFO2
InChI InChI=1S/C9H10ClFO2/c10-5-8(12)6-13-9-3-1-7(11)2-4-9/h1-4,8,12H,5-6H2/t8-/m1/s1
InChIKey OSIKOYZBGUHWAB-MRVPVSSYSA-N
Molecular Weight 204.628 g/mol
SMILES C=1(OC[C@](O)(CCl)[H])C=CC(=CC1)F