| SpectraBase Spectrum ID |
6HWSJyG3068 |
| Name |
Methyl 8-(2,6-dimethylphenyl)spiro[2,5]oct-7-ene-5-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.161979946 u |
| Formula |
C18H22O2 |
| InChI |
InChI=1S/C18H22O2/c1-12-5-4-6-13(2)16(12)15-8-7-14(17(19)20-3)11-18(15)9-10-18/h4-6,8,14H,7,9-11H2,1-3H3 |
| InChIKey |
ROQBPCOCIQAFSW-UHFFFAOYSA-N |
| Molecular Weight |
270.372 g/mol |
| SMILES |
C12(C(=CCC(C(=O)OC)C2)C=2C(=CC=CC2C)C)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842535 |
![Methyl 8-(2,6-dimethylphenyl)spiro[2,5]oct-7-ene-5-carboxylate](/api/spectrum/6HWSJyG3068/structure.png?h=300&w=458 "Methyl 8-(2,6-dimethylphenyl)spiro[2,5]oct-7-ene-5-carboxylate")
