SpectraBase Spectrum ID |
Br3K3OtjJG5 |
Name |
Bicyclo[8.2.2]tetradeca-5,10,12,13-tetraene-4-carboxylic acid, 7-cyano-, methyl ester, (4R*,5E,7S*)- |
CAS Registry Number |
66388-94-1 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H19NO2 |
InChI |
InChI=1S/C17H19NO2/c1-20-17(19)16-10-8-14-4-2-13(3-5-14)6-7-15(12-18)9-11-16/h2-5,9,11,15-16H,6-8,10H2,1H3/b11-9-/t15-,16+/m0/s1 |
InChIKey |
CJNQHPGBXLDYPZ-ZEIXHXPOSA-N |
Molecular Weight |
269.344 g/mol |
SMILES |
C(#N)[C@@]1(\C=C/[C@](C(=O)OC)(CCc2ccc(CC1)cc2)[H])[H] |
SPLASH |
splash10-014i-1940000000-48e32a54383a3df543ae |
Source of Spectrum |
C-100-1812-0 |
Synonyms |
4-Methoxycarbonyl-7-cyano-bicyclo[8.2.2]tetradeca-5-trans,10,12,13-tetraene
Methyl (4R,7S)-7-cyanobicyclo[8.2.2]tetradeca-1(12),5,10,13-tetraene-4-carboxylate |
Wiley ID |
1273372 |