| SpectraBase Spectrum ID |
3lkRYJYlk09 |
| Name |
Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 2-methyl-3-(4-methyl-3-pentenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.161979946 u |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-9(2)5-4-6-15(13(16)17)10-7-11-12(8-10)14(11,15)3/h5,10-12H,4,6-8H2,1-3H3,(H,16,17)/t10-,11+,12?,14?,15?/m0/s1 |
| InChIKey |
YLBIAPSZBASSLT-XMIWCSKKSA-N |
| Molecular Weight |
234.339 g/mol |
| SMILES |
C12([C@@]3(C[C@](C2(C(=O)O)CCC=C(C)C)(CC13)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801574 |
![Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 2-methyl-3-(4-methyl-3-pentenyl)-](/api/spectrum/3lkRYJYlk09/structure.png?h=300&w=458 "Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 2-methyl-3-(4-methyl-3-pentenyl)-")
