| SpectraBase Spectrum ID |
HWJic3OkK7c |
| Name |
N-(3-(4-Methoxyphenyl)prop-2-ynyl)pivalamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.141578854 u |
| Formula |
C15H19NO2 |
| InChI |
InChI=1S/C15H19NO2/c1-15(2,3)14(17)16-11-5-6-12-7-9-13(18-4)10-8-12/h7-10H,11H2,1-4H3,(H,16,17) |
| InChIKey |
NXPHPMTZUKYJGD-UHFFFAOYSA-N |
| Molecular Weight |
245.322 g/mol |
| SMILES |
C(C(C)(C)C)(=O)NCC#CC=1C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961048 |