| SpectraBase Spectrum ID |
BQa5kAQeC6H |
| Name |
(1RS,3aSR,5RS,7aSR)-7a-(2-cyanoethyl)octahydro-5-methyl-2,7-dioxo-1-[2-(4-methoxyphenyl)ethyl]-1H-indene |
| CAS Registry Number |
118892-23-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H27NO3 |
| InChI |
InChI=1S/C22H27NO3/c1-15-12-17-14-20(24)19(22(17,10-3-11-23)21(25)13-15)9-6-16-4-7-18(26-2)8-5-16/h4-5,7-8,15,17,19H,3,6,9-10,12-14H2,1-2H3 |
| InChIKey |
QMPVAVJWCRUKFT-UHFFFAOYSA-N |
| Molecular Weight |
353.462 g/mol |
| SMILES |
C12(C(CC(CC2CC(C1CCc1ccc(cc1)OC)=O)C)=O)CCC#N |
| SPLASH |
splash10-001i-0900000000-b6a8e871ebeabb3fc83a |
| Source of Spectrum |
J-54-1559-33 |
| Synonyms |
3-{3-[2-(4-methoxyphenyl)ethyl]-6-methyl-2,4-dioxooctahydro-3aH-inden-3a-yl}propanenitrile |
| Wiley ID |
1344083 |
![(1RS,3aSR,5RS,7aSR)-7a-(2-cyanoethyl)octahydro-5-methyl-2,7-dioxo-1-[2-(4-methoxyphenyl)ethyl]-1H-indene](/api/spectrum/BQa5kAQeC6H/structure.png?h=300&w=458 "(1RS,3aSR,5RS,7aSR)-7a-(2-cyanoethyl)octahydro-5-methyl-2,7-dioxo-1-[2-(4-methoxyphenyl)ethyl]-1H-indene")
