| SpectraBase Spectrum ID |
6dwh7jZHm7J |
| Name |
(5S,8R)-5-Isopropyl-8-methyl-2-methylene-3,9-decadien-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.198365456 u |
| Formula |
C15H26O |
| InChI |
InChI=1S/C15H26O/c1-6-13(4)7-9-15(12(2)3)10-8-14(5)11-16/h6,8,10,12-13,15-16H,1,5,7,9,11H2,2-4H3/b10-8+/t13-,15+/m0/s1 |
| InChIKey |
XLPWIJCULOOQLH-XMTZHVTGSA-N |
| Molecular Weight |
222.372 g/mol |
| SMILES |
C(\C=C\[C@@](CC[C@](C=C)(C)[H])(C(C)C)[H])(=C)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919314 |
