| SpectraBase Spectrum ID |
5nGQ1ABN4tf |
| Name |
3-(Heptyloxy)-3'-propoxy-1,1'-[(2-hydroxyethyl)imino]di-2-propanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.282823355 u |
| Formula |
C18H39NO5 |
| InChI |
InChI=1S/C18H39NO5/c1-3-5-6-7-8-12-24-16-18(22)14-19(9-10-20)13-17(21)15-23-11-4-2/h17-18,20-22H,3-16H2,1-2H3 |
| InChIKey |
KXMYXOYWGONOLF-UHFFFAOYSA-N |
| Molecular Weight |
349.512 g/mol |
| SMILES |
OC(CN(CCO)CC(COCCC)O)COCCCCCCC |
| Spectrum/Structure Validation Score (Raman) |
0.996059 |
