SpectraBase Spectrum ID |
HF9R52sCvA2 |
Name |
N-Ethyl-N-(1-methylpent-3-yn-2-yl)benzylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
215.167399680 u |
Formula |
C15H21N |
InChI |
InChI=1S/C15H21N/c1-5-12-15(3,4)16(6-2)13-14-10-8-7-9-11-14/h7-11H,6,13H2,1-4H3 |
InChIKey |
PCEHPEGYJOEFGE-UHFFFAOYSA-N |
Molecular Weight |
215.340 g/mol |
SMILES |
C1(=CC=CC=C1)CN(CC)C(C#CC)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952612 |