| SpectraBase Spectrum ID |
9ckq0Onk4yA |
| Name |
5-tert-Butyl-1-[3-(1-cyano-3,3-bis(methoxycarbonyl)butyl)phenyl}-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]heptane |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H33NO7 |
| InChI |
InChI=1S/C25H33NO7/c1-21(2,3)25-22(4,5)15-31-24(25,32-33-25)18-11-9-10-16(12-18)17(14-26)13-23(6,19(27)29-7)20(28)30-8/h9-12,17H,13,15H2,1-8H3 |
| InChIKey |
AHZCYXLKJSVIAG-UHFFFAOYSA-N |
| Molecular Weight |
459.539 g/mol |
| SMILES |
C12(C(C(C)(C)CO2)(C(C)(C)C)OO1)c1cc(C(CC(C(=O)OC)(C(=O)OC)C)C#N)ccc1 |
| SPLASH |
splash10-0udi-0009000000-34d26e15cbaf2c7ab0f7 |
| Source of Spectrum |
KC-61-9580-22 |
| Synonyms |
Dimethyl 2-{2-[3-(5-tert-butyl-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]hept-1-yl)phenyl]-2-cyanoethyl}-2-methylmalonate |
| Wiley ID |
1630764 |
![5-tert-Butyl-1-[3-(1-cyano-3,3-bis(methoxycarbonyl)butyl)phenyl}-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]heptane](/api/spectrum/9ckq0Onk4yA/structure.png?h=300&w=458 "5-tert-Butyl-1-[3-(1-cyano-3,3-bis(methoxycarbonyl)butyl)phenyl}-4,4-dimethyl-2,6,7-trioxabicyclo[3.2.0]heptane")
