| SpectraBase Spectrum ID |
8gstgXnzEiw |
| Name |
Carbamic acid, N-(2-butyl)-N-dodecyl-, 2,2,2-trichloroethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.181162501 u |
| Formula |
C19H36Cl3NO2 |
| InChI |
InChI=1S/C19H36Cl3NO2/c1-4-6-7-8-9-10-11-12-13-14-15-23(17(3)5-2)18(24)25-16-19(20,21)22/h17H,4-16H2,1-3H3 |
| InChIKey |
OGLJGPNBUQDLRP-UHFFFAOYSA-N |
| Molecular Weight |
416.861 g/mol |
| SMILES |
C(N(CCCCCCCCCCCC)C(CC)C)(=O)OCC(Cl)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921653 |
