| SpectraBase Spectrum ID |
eKe9y6eJhu |
| Name |
Trans-2,3-di(methoxycarbonyl)-3-methylbicyclo[2.2.2]oct-5-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.120509056 u |
| Formula |
C13H18O4 |
| InChI |
InChI=1S/C13H18O4/c1-13(12(15)17-3)9-6-4-8(5-7-9)10(13)11(14)16-2/h4,6,8-10H,5,7H2,1-3H3/t8-,9?,10+,13?/m0/s1 |
| InChIKey |
MICRTYBWEUFCBV-CUYBNKCWSA-N |
| Molecular Weight |
238.283 g/mol |
| SMILES |
C1([C@@](C(=O)OC)([C@@]2([H])C=CC1CC2)[H])(C(=O)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955391 |
![Trans-2,3-di(methoxycarbonyl)-3-methylbicyclo[2.2.2]oct-5-ene](/api/spectrum/eKe9y6eJhu/structure.png?h=300&w=458 "Trans-2,3-di(methoxycarbonyl)-3-methylbicyclo[2.2.2]oct-5-ene")
