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(2R)-2-amino-1,1-diphenyl-3-(phenylthio)-1-propanol
SpectraBase Compound ID JvKkGRhGghq
InChI InChI=1S/C21H21NOS/c22-20(16-24-19-14-8-3-9-15-19)21(23,17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-15,20,23H,16,22H2/t20-/m0/s1
InChIKey GXKRPBKLZDEDNQ-FQEVSTJZSA-N
Mol Weight 335.47 g/mol
Molecular Formula C21H21NOS
Exact Mass 335.134385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3HVUOkdZUd
Name (2R)-2-Amino-1,1-diphenyl-3-(phenylthio)-1-propanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.134385473 u
Formula C21H21NOS
InChI InChI=1S/C21H21NOS/c22-20(16-24-19-14-8-3-9-15-19)21(23,17-10-4-1-5-11-17)18-12-6-2-7-13-18/h1-15,20,23H,16,22H2/t20-/m0/s1
InChIKey GXKRPBKLZDEDNQ-FQEVSTJZSA-N
Molecular Weight 335.465 g/mol
SMILES C([C@](CSC1=CC=CC=C1)(N)[H])(C=1C=CC=CC1)(C=1C=CC=CC1)O