| SpectraBase Spectrum ID |
BId5QgvmyG1 |
| Name |
Bicyclo[2.2.2]oct-5-ene-2-methanol, .alpha.,.alpha.,3-trimethyl-, (1.alpha.,2.beta.,3.alpha.,4.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.151415263 u |
| Formula |
C12H20O |
| InChI |
InChI=1S/C12H20O/c1-8-9-4-6-10(7-5-9)11(8)12(2,3)13/h4,6,8-11,13H,5,7H2,1-3H3 |
| InChIKey |
HDQXVVVCIAELCM-UHFFFAOYSA-N |
| Molecular Weight |
180.291 g/mol |
| SMILES |
C1(C(C2C=CC1CC2)C)C(O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918589 |
![Bicyclo[2.2.2]oct-5-ene-2-methanol, .alpha.,.alpha.,3-trimethyl-, (1.alpha.,2.beta.,3.alpha.,4.alpha.)-](/api/spectrum/BId5QgvmyG1/structure.png?h=300&w=458 "Bicyclo[2.2.2]oct-5-ene-2-methanol, .alpha.,.alpha.,3-trimethyl-, (1.alpha.,2.beta.,3.alpha.,4.alpha.)-")
