SpectraBase Spectrum ID |
69m7HWSqoEf |
Name |
Isonipecotic acid, N-methacryloyl-, dodecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
365.292994117 u |
Formula |
C22H39NO3 |
InChI |
InChI=1S/C22H39NO3/c1-4-5-6-7-8-9-10-11-12-13-18-26-22(25)20-14-16-23(17-15-20)21(24)19(2)3/h20H,2,4-18H2,1,3H3 |
InChIKey |
MWADMLOJYWCICL-UHFFFAOYSA-N |
Molecular Weight |
365.558 g/mol |
SMILES |
CCCCCCCCCCCCOC(C1CCN(C(=O)C(=C)C)CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963105 |