| SpectraBase Spectrum ID |
4jmzPDd338p |
| Name |
3-Cyano-4-trifluoromethyl-1,5,6,7,8,9,10,11-octahydro-5,9;7,11-dimethano[9]annuleno[b]pyridin-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15F3N2O |
| InChI |
InChI=1S/C16H15F3N2O/c17-16(18,19)13-11(6-20)15(22)21-14-10-4-7-1-8(5-10)3-9(2-7)12(13)14/h7-10H,1-5H2,(H,21,22)/t7-,8+,9-,10+ |
| InChIKey |
CYWSUTCAABVCPQ-YNFQOJQRSA-N |
| Molecular Weight |
308.304 g/mol |
| SMILES |
N1C2=C(C(=C(C1=O)C#N)C(F)(F)F)[C@@]1(C[C@]3(C[C@]2(C[C@@](C1)(C3)[H])[H])[H])[H] |
| SPLASH |
splash10-0a4i-0029000000-a06bd31f981d61f7f638 |
| Source of Spectrum |
H1-42-338-9 |
| Synonyms |
4-Oxo-6-(trifluoromethyl)-3-azatetracyclo[8.3.1.1(8,12).0(2,7)]pentadeca-2(7),5-diene-5-carbonitrile |
| Wiley ID |
757569 |
![3-Cyano-4-trifluoromethyl-1,5,6,7,8,9,10,11-octahydro-5,9;7,11-dimethano[9]annuleno[b]pyridin-2-one](/api/spectrum/4jmzPDd338p/structure.png?h=300&w=458 "3-Cyano-4-trifluoromethyl-1,5,6,7,8,9,10,11-octahydro-5,9;7,11-dimethano[9]annuleno[b]pyridin-2-one")
