| SpectraBase Spectrum ID |
3csyaZFEqWn |
| Name |
Methyl 2,6-dimethyl-8-methylene-7-(methoxycarbonylmethyl)bicyclo[4.4.0]decane-2-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.198759378 u |
| Formula |
C18H28O4 |
| InChI |
InChI=1S/C18H28O4/c1-12-7-8-14-17(2,13(12)11-15(19)21-4)9-6-10-18(14,3)16(20)22-5/h13-14H,1,6-11H2,2-5H3/t13-,14?,17+,18-/m0/s1 |
| InChIKey |
PEEWTCSWPSHLQM-YSCYIJJASA-N |
| Molecular Weight |
308.418 g/mol |
| SMILES |
[C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC([C@@]1(CC(=O)OC)[H])=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977273 |
![Methyl 2,6-dimethyl-8-methylene-7-(methoxycarbonylmethyl)bicyclo[4.4.0]decane-2-carboxylate](/api/spectrum/3csyaZFEqWn/structure.png?h=300&w=458 "Methyl 2,6-dimethyl-8-methylene-7-(methoxycarbonylmethyl)bicyclo[4.4.0]decane-2-carboxylate")
