SpectraBase Spectrum ID |
KEwAupAWLhn |
Name |
N-Methyl-N-(1-phenylpropyl)butan-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/c1-4-6-12-15(3)14(5-2)13-10-8-7-9-11-13/h7-11,14H,4-6,12H2,1-3H3 |
InChIKey |
FPKCWYWIQVLKOC-UHFFFAOYSA-N |
Molecular Weight |
205.345 g/mol |
SMILES |
C1(C(N(CCCC)C)CC)=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94228 |