| SpectraBase Spectrum ID |
DioZJG1TrP5 |
| Name |
.beta.-Alanine, N-acryloyl-, hexadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.308644181 u |
| Formula |
C22H41NO3 |
| InChI |
InChI=1S/C22H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-26-22(25)18-19-23-21(24)4-2/h4H,2-3,5-20H2,1H3,(H,23,24) |
| InChIKey |
WIOZKABCIJIXOA-UHFFFAOYSA-N |
| Molecular Weight |
367.574 g/mol |
| SMILES |
C=CC(NCCC(OCCCCCCCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94025 |
