SpectraBase Spectrum ID |
KZlpsuQLXtc |
Name |
Benzamide, 4-bromo-N-(2-phenylethyl)-N-pentyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.104127396 u |
Formula |
C20H24BrNO |
InChI |
InChI=1S/C20H24BrNO/c1-2-3-7-15-22(16-14-17-8-5-4-6-9-17)20(23)18-10-12-19(21)13-11-18/h4-6,8-13H,2-3,7,14-16H2,1H3 |
InChIKey |
PUMHYFITDIPPAY-UHFFFAOYSA-N |
Molecular Weight |
374.322 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)Br)CCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934195 |