| SpectraBase Spectrum ID |
31AzNQpgwWE |
| Name |
N-(but-2''-Ynyl)-3-[2'-(1''',3'''-dioxan-2'''-yl)ethyl]-N-methylaniline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
229.146664235 u |
| Formula |
C15H19NO |
| InChI |
InChI=1S/C15H19NO/c1-3-4-10-16(2)14-7-5-6-13(11-14)8-9-15-12-17-15/h5-7,11,15H,8-10,12H2,1-2H3 |
| InChIKey |
AGJCJUVWWTVPEF-UHFFFAOYSA-N |
| Molecular Weight |
229.323 g/mol |
| SMILES |
C1(OC1)CCC=1C=C(N(CC#CC)C)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896836 |
![N-(But-2''-ynyl)-3-[2'-(1'",3"'-dioxan-2'''-yl)ethyl]-N-methylaniline](/api/spectrum/31AzNQpgwWE/structure.png?h=300&w=458 "N-(But-2''-ynyl)-3-[2'-(1'\",3\"'-dioxan-2'''-yl)ethyl]-N-methylaniline")
