| SpectraBase Spectrum ID |
47vgYDBFv5c |
| Name |
1-Phenanthrenecarboxylic acid, 9-bromo-1,2,3,4,4a,10a-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,10a.alpha.)]- |
| Alternate Name(s) |
1,2,4,4a,10a-hexahydro-9-bromo-1,4a-dimethyl-7-(1-methylethenyl)-1-phenanthrenecarboxylic acid
Methyl (4beta)-7-bromoabieta-6,8,11,13,15(17)-pentaen-18-oate |
| CAS Registry Number |
90164-56-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25BrO2 |
| InChI |
InChI=1S/C21H25BrO2/c1-13(2)14-7-8-16-15(11-14)17(22)12-18-20(16,3)9-6-10-21(18,4)19(23)24-5/h7-8,11-12,18H,1,6,9-10H2,2-5H3/t18-,20-,21-/m1/s1 |
| InChIKey |
CEFUXDBUQNENPH-HMXCVIKNSA-N |
| Molecular Weight |
389.333 g/mol |
| SMILES |
[C@]12([C@@](c3ccc(cc3C(=C2)Br)C(=C)C)(CCC[C@]1(C(=O)OC)C)C)[H] |
| SPLASH |
splash10-014l-9001000000-1e5671e6ae3ed2772c23 |
| Source of Spectrum |
AH-114-1264-0 |
| Wiley ID |
1363806 |
![1-Phenanthrenecarboxylic acid, 9-bromo-1,2,3,4,4a,10a-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-](/api/spectrum/47vgYDBFv5c/structure.png?h=300&w=458 "1-Phenanthrenecarboxylic acid, 9-bromo-1,2,3,4,4a,10a-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-")
