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(1S)-(-)-1-(4-chlorophenyl)-2-phenylethyl acetate
SpectraBase Compound ID 1yKDAzXPzo7
InChI InChI=1S/C16H15ClO2/c1-12(18)19-16(11-13-5-3-2-4-6-13)14-7-9-15(17)10-8-14/h2-10,16H,11H2,1H3/t16-/m0/s1
InChIKey WINYDTQMUQEHPS-INIZCTEOSA-N
Mol Weight 274.75 g/mol
Molecular Formula C16H15ClO2
Exact Mass 274.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D6XV6ImMSYr
Name (1S)-(-)-1-(4-chlorophenyl)-2-phenylethyl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.076057421 u
Formula C16H15ClO2
InChI InChI=1S/C16H15ClO2/c1-12(18)19-16(11-13-5-3-2-4-6-13)14-7-9-15(17)10-8-14/h2-10,16H,11H2,1H3/t16-/m0/s1
InChIKey WINYDTQMUQEHPS-INIZCTEOSA-N
Molecular Weight 274.747 g/mol
SMILES [C@](OC(=O)C)(C=1C=CC(=CC1)Cl)(CC1=CC=CC=C1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.891565