| SpectraBase Spectrum ID |
JeN4phr3hNv |
| Name |
Carbonic acid, monoamide, N-(2-pentyl)-N-methyl-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
257.235479240 u |
| Formula |
C15H31NO2 |
| InChI |
InChI=1S/C15H31NO2/c1-6-9-11-14(8-3)12-18-15(17)16(5)13(4)10-7-2/h13-14H,6-12H2,1-5H3 |
| InChIKey |
VCSNRXBTGHBJOL-UHFFFAOYSA-N |
| Molecular Weight |
257.418 g/mol |
| SMILES |
CCCC(C)N(C(OCC(CCCC)CC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971788 |
