| SpectraBase Spectrum ID |
HdIuhoi1mAO |
| Name |
4a,7-Methano-4aH-benzocycloheptene-1-propanoic acid, decahydro-7-(methoxycarbonyl)-1-methyl-2-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,2.beta.,4a.alpha.,7.beta.,9a.alpha.)]- |
| CAS Registry Number |
70474-86-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H36O4 |
| InChI |
InChI=1S/C22H36O4/c1-15(2)16-6-10-21-12-13-22(14-21,19(24)26-5)11-7-17(21)20(16,3)9-8-18(23)25-4/h15-17H,6-14H2,1-5H3/t16-,17+,20-,21-,22-/m1/s1 |
| InChIKey |
XEGWBGFBYLXWND-MPMRWZLSSA-N |
| Molecular Weight |
364.526 g/mol |
| SMILES |
[C@]1([C@]2([C@]3(C[C@](CC2)(C(=O)OC)CC3)CC[C@@]1(C(C)C)[H])[H])(CCC(=O)OC)C |
| SPLASH |
splash10-004i-0092000000-9130ac2635df78e56555 |
| Source of Spectrum |
F-34-3340-0 |
| Synonyms |
1-Carboxy-5-carboxyethyl-6-isopropyl-5-methyltricyclo(7.2.1.0**4,8)dodecane methyl ester
Methyl (1R,4R,5R,6R,9R)-4-isopropyl-5-(3-methoxy-3-oxopropyl)-5-methyltricyclo[7.2.1.0(1,6)]dodecane-9-carboxylate |
| Wiley ID |
1351015 |
![4a,7-Methano-4aH-benzocycloheptene-1-propanoic acid, decahydro-7-(methoxycarbonyl)-1-methyl-2-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,2.beta.,4a.alpha.,7.beta.,9a.alpha.)]-](/api/spectrum/HdIuhoi1mAO/structure.png?h=300&w=458 "4a,7-Methano-4aH-benzocycloheptene-1-propanoic acid, decahydro-7-(methoxycarbonyl)-1-methyl-2-(1-methylethyl)-, methyl ester, [1R-(1.alpha.,2.beta.,4a.alpha.,7.beta.,9a.alpha.)]-")
