| SpectraBase Spectrum ID |
7uJ9QpzS1Zg |
| Name |
2-Oxazoline, 4,4-dimethyl-2-(10,11-dichloroheptadecyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.256520343 u |
| Formula |
C22H41Cl2NO |
| InChI |
InChI=1S/C22H41Cl2NO/c1-4-5-6-12-15-19(23)20(24)16-13-10-8-7-9-11-14-17-21-25-22(2,3)18-26-21/h19-20H,4-18H2,1-3H3 |
| InChIKey |
RTRQHHSUSNWXJV-UHFFFAOYSA-N |
| Molecular Weight |
406.482 g/mol |
| SMILES |
C1C(N=C(O1)CCCCCCCCCC(C(CCCCCC)Cl)Cl)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.805808 |
