| SpectraBase Spectrum ID |
I4pjARd1MDG |
| Name |
Carbonic acid, monoamide, N-propyl-N-octyl-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.313729562 u |
| Formula |
C20H41NO2 |
| InChI |
InChI=1S/C20H41NO2/c1-5-9-11-12-13-14-17-21(16-7-3)20(22)23-18-19(8-4)15-10-6-2/h19H,5-18H2,1-4H3 |
| InChIKey |
MRWWGJZDCDFGOK-UHFFFAOYSA-N |
| Molecular Weight |
327.553 g/mol |
| SMILES |
C(=O)(OCC(CCCC)CC)N(CCC)CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965395 |
