| SpectraBase Spectrum ID |
IAXTBB9ZvS2 |
| Name |
Carbamic acid, N-(2-butyl)-N-pentyl-, propyl 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/c1-5-8-9-10-14(12(4)7-3)13(15)16-11-6-2/h12H,5-11H2,1-4H3 |
| InChIKey |
FAHYNNALSNDDAW-UHFFFAOYSA-N |
| Molecular Weight |
229.364 g/mol |
| SMILES |
C(N(CCCCC)C(CC)C)(=O)OCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903279 |
