| SpectraBase Spectrum ID |
Hehb7OQ9izd |
| Name |
Tricyclo[6.2.2.01,8]dodeca-4,11-diene-9-carboxylic acid, (1.alpha.,8.alpha.,9.beta.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.115029753 u |
| Formula |
C13H16O2 |
| InChI |
InChI=1S/C13H16O2/c14-11(15)10-9-12-5-3-1-2-4-6-13(10,12)8-7-12/h1-2,7-8,10H,3-6,9H2,(H,14,15)/b2-1-/t10-,12-,13+/m1/s1 |
| InChIKey |
ZFJXCEISBWLWEL-VMBDATQSSA-N |
| Molecular Weight |
204.269 g/mol |
| SMILES |
[C@]123[C@](CC\C=C/CC3)(C=C1)C[C@@]2(C(=O)O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97328 |
![Tricyclo[6.2.2.01,8]dodeca-4,11-diene-9-carboxylic acid, (1.alpha.,8.alpha.,9.beta.)-](/api/spectrum/Hehb7OQ9izd/structure.png?h=300&w=458 "Tricyclo[6.2.2.01,8]dodeca-4,11-diene-9-carboxylic acid, (1.alpha.,8.alpha.,9.beta.)-")
