| SpectraBase Spectrum ID |
64YkNYuIFBo |
| Name |
trans-1-methyl-4-isopropyl-2,3-di(methoxycarbonyl)-bicyclo[2.2.2]oct-5-ene |
| Alternate Name(s) |
dimethyl (3R,4R)-1-isopropyl-4-methylbicyclo[2.2.2]oct-5-ene-2,3-dicarboxylate |
| CAS Registry Number |
121824-68-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H24O4 |
| InChI |
InChI=1S/C16H24O4/c1-10(2)16-8-6-15(3,7-9-16)11(13(17)19-4)12(16)14(18)20-5/h6,8,10-12H,7,9H2,1-5H3/t11-,12?,15-,16?/m0/s1 |
| InChIKey |
UXJMNIRBJQQJJP-UUGHVDCASA-N |
| Molecular Weight |
280.364 g/mol |
| SMILES |
C12(C([C@](C(=O)OC)([H])[C@@](CC2)(C)C=C1)C(=O)OC)C(C)C |
| SPLASH |
splash10-0002-0900000000-ef3b9ec9d54479957659 |
| Source of Spectrum |
O-24-39-0 |
| Wiley ID |
1283981 |
![trans-1-methyl-4-isopropyl-2,3-di(methoxycarbonyl)-bicyclo[2.2.2]oct-5-ene](/api/spectrum/64YkNYuIFBo/structure.png?h=300&w=458 "trans-1-methyl-4-isopropyl-2,3-di(methoxycarbonyl)-bicyclo[2.2.2]oct-5-ene")
