| SpectraBase Spectrum ID |
5jRDOjcWxnS |
| Name |
2-((3aS,7aR)-2-(4-chlorobutyl)-1-oxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoinden-3-yl)isonicotinonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H19ClN2O |
| InChI |
InChI=1S/C20H19ClN2O/c21-7-2-1-3-15-19(16-9-12(11-22)6-8-23-16)17-13-4-5-14(10-13)18(17)20(15)24/h4-6,8-9,13-14,17-18H,1-3,7,10H2/t13-,14+,17-,18-/m1/s1 |
| InChIKey |
BGZZBHVBWQVJEO-LTCOOKNTSA-N |
| Molecular Weight |
338.838 g/mol |
| SMILES |
C1(=C(C(=O)[C@]2([C@]1([C@@]1(C=C[C@]2(C1)[H])[H])[H])[H])CCCCCl)c1nccc(C#N)c1 |
| SPLASH |
splash10-014l-9056000000-bea51fe0bca557c5815b |
| Source of Spectrum |
F4-46-12-4a |
| Synonyms |
2-((3aS,4S,7R,7aR)-2-(4-chlorobutyl)-1-oxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoinden-3-yl)isonicotinonitrile |
| Wiley ID |
1742129 |
