| SpectraBase Spectrum ID |
90t7xoBOkW0 |
| Name |
Carbonic acid, monoamide, N-benzyl-N-nonyl-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.329379627 u |
| Formula |
C25H43NO2 |
| InChI |
InChI=1S/C25H43NO2/c1-4-7-9-10-11-12-16-20-26(21-24-18-14-13-15-19-24)25(27)28-22-23(6-3)17-8-5-2/h13-15,18-19,23H,4-12,16-17,20-22H2,1-3H3 |
| InChIKey |
XVYCDJFITIYMDE-UHFFFAOYSA-N |
| Molecular Weight |
389.624 g/mol |
| SMILES |
C(N(CCCCCCCCC)CC1=CC=CC=C1)(=O)OCC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958853 |
