| SpectraBase Spectrum ID |
of0wd5p0p8 |
| Name |
.beta.-Alanine, N-acryloyl-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.246043924 u |
| Formula |
C18H33NO3 |
| InChI |
InChI=1S/C18H33NO3/c1-3-5-6-7-8-9-10-11-12-13-16-22-18(21)14-15-19-17(20)4-2/h4H,2-3,5-16H2,1H3,(H,19,20) |
| InChIKey |
DRTDMOMXTHYZLJ-UHFFFAOYSA-N |
| Molecular Weight |
311.466 g/mol |
| SMILES |
C=CC(NCCC(OCCCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96834 |
