| SpectraBase Spectrum ID |
5bsF2Rm4he3 |
| Name |
Carbamic acid, N-(2-butyl)-N-(3-methylbutyl)-, allyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.188529047 u |
| Formula |
C13H25NO2 |
| InChI |
InChI=1S/C13H25NO2/c1-6-10-16-13(15)14(12(5)7-2)9-8-11(3)4/h6,11-12H,1,7-10H2,2-5H3 |
| InChIKey |
HIUGNVOPLUBXPV-UHFFFAOYSA-N |
| Molecular Weight |
227.348 g/mol |
| SMILES |
C(N(CCC(C)C)C(CC)C)(=O)OCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958299 |
