SpectraBase Spectrum ID |
qmmPjpXeY9 |
Name |
N-(N-Butyl)-1-phenylcyclohexylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.198699809 u |
Formula |
C16H25N |
InChI |
InChI=1S/C16H25N/c1-2-3-14-17-16(12-8-5-9-13-16)15-10-6-4-7-11-15/h4,6-7,10-11,17H,2-3,5,8-9,12-14H2,1H3 |
InChIKey |
IWLNVGMIYJAWHV-UHFFFAOYSA-N |
Molecular Weight |
231.383 g/mol |
SMILES |
C1CC(CCC1)(NCCCC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923498 |