| SpectraBase Spectrum ID |
E2s5bGfPexI |
| Name |
Carbamic acid, N-(2-butyl)-N-isobutyl-, isobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
229.204179111 u |
| Formula |
C13H27NO2 |
| InChI |
InChI=1S/C13H27NO2/c1-7-12(6)14(8-10(2)3)13(15)16-9-11(4)5/h10-12H,7-9H2,1-6H3 |
| InChIKey |
TVEQWUJOXKBEQE-UHFFFAOYSA-N |
| Molecular Weight |
229.364 g/mol |
| SMILES |
C(N(CC(C)C)C(CC)C)(=O)OCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977548 |
