SpectraBase Spectrum ID |
4yAIFmtdTsF |
Name |
4-Phenylbutylamine, N,N-diacetyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.141578854 u |
Formula |
C14H19NO2 |
InChI |
InChI=1S/C14H19NO2/c1-12(16)15(13(2)17)11-7-6-10-14-8-4-3-5-9-14/h3-5,8-9H,6-7,10-11H2,1-2H3 |
InChIKey |
RLDOCVMVYKZGIR-UHFFFAOYSA-N |
Molecular Weight |
233.311 g/mol |
SMILES |
C(N(C(=O)C)C(=O)C)CCCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976738 |