| SpectraBase Spectrum ID |
LTfC3qzkhlV |
| Name |
Methyl 3-[4'-(1"-hydroxy-1"-methylethyl)-2'-carboxyphenyl)-1.beta.,2.beta-dimethyl-2-oxocyclohexane]-carboxylate |
| Alternate Name(s) |
Methyl 3-[4'-(1''-hydroxy-1''-methylethyl)-2'-carboxyphenyl)-1.beta.,2..beta.-dimethyl-2-oxocyclohexane]-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O6 |
| InChI |
InChI=1S/C20H26O6/c1-17(2,23)12-7-8-14-13(11-12)15(21)26-20(24)18(14,3)9-6-10-19(20,4)16(22)25-5/h7-8,11,23-24H,6,9-10H2,1-5H3/t18-,19+,20+/m1/s1 |
| InChIKey |
MVJKAUIJAKFIKG-AABGKKOBSA-N |
| Molecular Weight |
362.422 g/mol |
| SMILES |
OC(c1ccc2c(C(O[C@]3([C@@]2(CCC[C@]3(C(=O)OC)C)C)O)=O)c1)(C)C |
| SPLASH |
splash10-014i-2091000000-0de05969860c44e8fe16 |
| Source of Spectrum |
X2-52-93-7 |
| Wiley ID |
1602985 |
![Methyl 3-[4'-(1"-hydroxy-1"-methylethyl)-2'-carboxyphenyl)-1.beta.,2.beta-dimethyl-2-oxocyclohexane]-carboxylate](/api/spectrum/LTfC3qzkhlV/structure.png?h=300&w=458 "Methyl 3-[4'-(1\"-hydroxy-1\"-methylethyl)-2'-carboxyphenyl)-1.beta.,2.beta-dimethyl-2-oxocyclohexane]-carboxylate")
