SpectraBase Spectrum ID |
9IZI0C5mVka |
Name |
3-(4-Butylphenyl)-N,N-dimethyl-1-propanamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.198699809 u |
Formula |
C15H25N |
InChI |
InChI=1S/C15H25N/c1-4-5-7-14-9-11-15(12-10-14)8-6-13-16(2)3/h9-12H,4-8,13H2,1-3H3 |
InChIKey |
FMJHFMNQOHYKEG-UHFFFAOYSA-N |
Molecular Weight |
219.372 g/mol |
SMILES |
C(N(C)C)CCC=1C=CC(=CC1)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939911 |