| SpectraBase Spectrum ID |
292nRL8ujy5 |
| Name |
Carbonic acid, monoamide, N-benzyl-N-heptyl-, 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/c1-4-7-9-10-14-18-24(19-22-16-12-11-13-17-22)23(25)26-20-21(6-3)15-8-5-2/h11-13,16-17,21H,4-10,14-15,18-20H2,1-3H3 |
| InChIKey |
VTVPYJJKGIVBFT-UHFFFAOYSA-N |
| Molecular Weight |
361.570 g/mol |
| SMILES |
C(N(CCCCCCC)CC1=CC=CC=C1)(=O)OCC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957981 |
