SpectraBase Spectrum ID |
C7CK2MZ851P |
Name |
N,N-Diethyl-4-(o-tolyloxy)but-2-yn-1-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.162314299 u |
Formula |
C15H21NO |
InChI |
InChI=1S/C15H21NO/c1-4-16(5-2)12-8-9-13-17-15-11-7-6-10-14(15)3/h6-7,10-11H,4-5,12-13H2,1-3H3 |
InChIKey |
AERRADKSIFUEFI-UHFFFAOYSA-N |
Molecular Weight |
231.339 g/mol |
SMILES |
C(C#CCOC=1C(=CC=CC1)C)N(CC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888756 |