| SpectraBase Spectrum ID |
9WtIysWP3ns |
| Name |
Trans-verbenyl isovalerate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-9(2)6-14(16)17-13-7-10(3)11-8-12(13)15(11,4)5/h7,9,11-13H,6,8H2,1-5H3 |
| InChIKey |
RYICZYJEOUZTHU-UHFFFAOYSA-N |
| Molecular Weight |
236.355 g/mol |
| SMILES |
C(CC(C)C)(=O)OC1C2C(C(C2)C(=C1)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970572 |
