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 |