| SpectraBase Spectrum ID |
5NWP0wTTm1J |
| Name |
Carbonic acid, monoamide, N-propyl-N-decyl-, benzyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.266779369 u |
| Formula |
C21H35NO2 |
| InChI |
InChI=1S/C21H35NO2/c1-3-5-6-7-8-9-10-14-18-22(17-4-2)21(23)24-19-20-15-12-11-13-16-20/h11-13,15-16H,3-10,14,17-19H2,1-2H3 |
| InChIKey |
TUUVJCIZIOHRMU-UHFFFAOYSA-N |
| Molecular Weight |
333.516 g/mol |
| SMILES |
C(N(CCC)CCCCCCCCCC)(=O)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917706 |
