| SpectraBase Spectrum ID |
aa6cPxqFM |
| Name |
(4Z)-7-[1,2-Bis(4-cyanophenyl)-2,3,3a,4,5,8,9,9a-octahydro-1H-trans-cyclooctapyrazol-3-yl]-4-heptenal |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H32N4O |
| InChI |
InChI=1S/C30H32N4O/c31-22-24-13-17-26(18-14-24)33-29(11-7-2-1-5-9-21-35)28-10-6-3-4-8-12-30(28)34(33)27-19-15-25(23-32)16-20-27/h1-4,13-21,28-30H,5-12H2/b2-1-,4-3-/t28-,29?,30+/m1/s1 |
| InChIKey |
MOYOFKGFSGLKHF-IXGAJMIHSA-N |
| Literature Reference DOI |
10.1002/cber.19821150620 |
| Molecular Weight |
464.613 g/mol |
| SMILES |
C1C[C@]2([C@](CC\C=C/1)(N(N(C2CC\C=C/CCC=O)c1ccc(cc1)C#N)c1ccc(cc1)C#N)[H])[H] |
| SPLASH |
splash10-0w29-2316900000-2557273d8496f6395559 |
| Source of Spectrum |
K-115-2252-25 |
| Synonyms |
4,4'-((3aS,9aS,Z)-3-((Z)-7-oxohept-3-en-1-yl)-3a,4,5,8,9,9a-hexahydro-1H-cycloocta[c]pyrazole-1,2(3H)-diyl)dibenzonitrile |
| Wiley ID |
1791971 |
![(4Z)-7-[1,2-Bis(4-cyanophenyl)-2,3,3a,4,5,8,9,9a-octahydro-1H-trans-cyclooctapyrazol-3-yl]-4-heptenal](/api/spectrum/aa6cPxqFM/structure.png?h=300&w=458 "(4Z)-7-[1,2-Bis(4-cyanophenyl)-2,3,3a,4,5,8,9,9a-octahydro-1H-trans-cyclooctapyrazol-3-yl]-4-heptenal")
