| SpectraBase Spectrum ID |
6MOzkfbv3fG |
| Name |
Carbonic acid, monoamide, N-octadecyl-, 3-chloropropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.306057359 u |
| Formula |
C22H44ClNO2 |
| InChI |
InChI=1S/C22H44ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-22(25)26-21-18-19-23/h2-21H2,1H3,(H,24,25) |
| InChIKey |
RAZXUZQLZUPHOH-UHFFFAOYSA-N |
| Molecular Weight |
390.052 g/mol |
| SMILES |
C(CCNC(OCCCCl)=O)CCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828508 |
