| SpectraBase Spectrum ID |
LA1jlR440G6 |
| Name |
Carbonic acid, monoamide, N-(2-phenylethyl)-N-undecyl-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
431.376329820 u |
| Formula |
C28H49NO2 |
| InChI |
InChI=1S/C28H49NO2/c1-4-7-9-10-11-12-13-14-18-23-29(24-22-27-20-16-15-17-21-27)28(30)31-25-26(6-3)19-8-5-2/h15-17,20-21,26H,4-14,18-19,22-25H2,1-3H3 |
| InChIKey |
UUBCLSCGKAJGMD-UHFFFAOYSA-N |
| Molecular Weight |
431.705 g/mol |
| SMILES |
C1=CC=CC(=C1)CCN(C(=O)OCC(CC)CCCC)CCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960226 |
