| SpectraBase Spectrum ID |
3HrL47nKjMf |
| Name |
Carbonic acid, monoamide, N-propyl-N-nonyl-, 3-chloropropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.212156972 u |
| Formula |
C16H32ClNO2 |
| InChI |
InChI=1S/C16H32ClNO2/c1-3-5-6-7-8-9-10-14-18(13-4-2)16(19)20-15-11-12-17/h3-15H2,1-2H3 |
| InChIKey |
GEQORIJZIHHYQD-UHFFFAOYSA-N |
| Molecular Weight |
305.890 g/mol |
| SMILES |
C(=O)(OCCCCl)N(CCC)CCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917917 |
