SpectraBase Spectrum ID |
DqxsiZWvhSD |
Name |
Benzamide, 4-chloro-N-(2-phenylethyl)-N-octyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
371.201592289 u |
Formula |
C23H30ClNO |
InChI |
InChI=1S/C23H30ClNO/c1-2-3-4-5-6-10-18-25(19-17-20-11-8-7-9-12-20)23(26)21-13-15-22(24)16-14-21/h7-9,11-16H,2-6,10,17-19H2,1H3 |
InChIKey |
QKAXWGQTSCWPKH-UHFFFAOYSA-N |
Molecular Weight |
371.952 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)Cl)CCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844682 |