| SpectraBase Spectrum ID |
fmuAgRBthq |
| Name |
Carbonic acid, monoamide, N-benzyl-N-(hept-2-yl)-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.298079498 u |
| Formula |
C23H39NO2 |
| InChI |
InChI=1S/C23H39NO2/c1-5-8-11-14-20(4)24(18-22-16-12-10-13-17-22)23(25)26-19-21(7-3)15-9-6-2/h10,12-13,16-17,20-21H,5-9,11,14-15,18-19H2,1-4H3 |
| InChIKey |
QMQBFSYIJWSGGD-UHFFFAOYSA-N |
| Molecular Weight |
361.570 g/mol |
| SMILES |
C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)OCC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933522 |
