| SpectraBase Spectrum ID |
8MgmLTsyIzt |
| Name |
2-Docosanone, 4,21,21-trimethyl-, L-(-)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.386166229 u |
| Formula |
C25H50O |
| InChI |
InChI=1S/C25H50O/c1-23(22-24(2)26)20-18-16-14-12-10-8-6-7-9-11-13-15-17-19-21-25(3,4)5/h23H,6-22H2,1-5H3 |
| InChIKey |
CBWFLVMYHHVPBR-UHFFFAOYSA-N |
| Molecular Weight |
366.674 g/mol |
| SMILES |
C(CCCCCCCCCCCCCCCCC(C)(C)C)(CC(C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940827 |
