| SpectraBase Spectrum ID |
ISvxQlCvjha |
| Name |
9-Undecen-3-one, 2,2,6,6,10-pentamethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.229665585 u |
| Formula |
C16H30O |
| InChI |
InChI=1S/C16H30O/c1-13(2)9-8-11-16(6,7)12-10-14(17)15(3,4)5/h9H,8,10-12H2,1-7H3 |
| InChIKey |
RWHZIEJJMXQKES-UHFFFAOYSA-N |
| Molecular Weight |
238.415 g/mol |
| SMILES |
C(C(C)(C)C)(=O)CCC(CCC=C(C)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933757 |
