| SpectraBase Spectrum ID |
AfW1Lnt0WDO |
| Name |
(E)-methyl 3-(4-cyanobenzylidene)-4-oxooctahydropentalene-3a-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17NO3 |
| InChI |
InChI=1S/C18H17NO3/c1-22-17(21)18-14(8-9-16(18)20)6-7-15(18)10-12-2-4-13(11-19)5-3-12/h2-5,10,14H,6-9H2,1H3/b15-10+ |
| InChIKey |
PDPFNLHVDOAEDQ-XNTDXEJSSA-N |
| Literature Reference DOI |
10.1002/adsc.201600175 |
| Molecular Weight |
295.338 g/mol |
| SMILES |
C12(\C(CCC2CCC1=O)=C\c1ccc(cc1)C#N)C(=O)OC |
| SPLASH |
splash10-0a4i-1390000000-59222d453ef85ca417e9 |
| Source of Spectrum |
ASC-358-1820/SM16-39c |
| Synonyms |
Methyl (E)-3-(4-cyanobenzylidene)-4-oxohexahydropentalene-3a(1H)-carboxylate |
| Wiley ID |
1807420 |
