SpectraBase Spectrum ID |
FRnBULChdCj |
Name |
N-(3-Pentyl)-3-phenylpropan-1-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
205.183049745 u |
Formula |
C14H23N |
InChI |
InChI=1S/C14H23N/c1-3-14(4-2)15-12-8-11-13-9-6-5-7-10-13/h5-7,9-10,14-15H,3-4,8,11-12H2,1-2H3 |
InChIKey |
AVVGJFMWGGEWSB-UHFFFAOYSA-N |
Molecular Weight |
205.345 g/mol |
SMILES |
C(NCCCC1=CC=CC=C1)(CC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97531 |