| SpectraBase Spectrum ID |
5In6E2SYsYn |
| Name |
Carbonic acid, monoamide, N-propyl-N-(hept-2-yl)-, hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.266779369 u |
| Formula |
C17H35NO2 |
| InChI |
InChI=1S/C17H35NO2/c1-5-8-10-12-15-20-17(19)18(14-7-3)16(4)13-11-9-6-2/h16H,5-15H2,1-4H3 |
| InChIKey |
RUQGANUFKDGVHY-UHFFFAOYSA-N |
| SMILES |
C(=O)(OCCCCCC)N(CCC)C(CCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854601 |
