SpectraBase Spectrum ID |
EKM7f5kEa5A |
Name |
N-Methyl-N-[3-(p-tolyl)prop-2-yn-1-yl]prop-2-en-1-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
199.136099551 u |
Formula |
C14H17N |
InChI |
InChI=1S/C14H17N/c1-4-11-15(3)12-5-6-14-9-7-13(2)8-10-14/h4,7-10H,1,11-12H2,2-3H3 |
InChIKey |
ZWBSOFYGAFOFPF-UHFFFAOYSA-N |
Molecular Weight |
199.297 g/mol |
SMILES |
C(C=C)N(CC#CC1=CC=C(C=C1)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923523 |