SpectraBase Spectrum ID |
6jY1wiAh0nZ |
Name |
2-(3-fluorophenyl)-4-hydroxy-6-keto-4-methyl-cyclohexane-1,3-dicarboxylic acid ditert-butyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H31FO6 |
InChI |
InChI=1S/C23H31FO6/c1-21(2,3)29-19(26)17-15(25)12-23(7,28)18(20(27)30-22(4,5)6)16(17)13-9-8-10-14(24)11-13/h8-11,16-18,28H,12H2,1-7H3 |
InChIKey |
PFQZJEUDBCQQSR-UHFFFAOYSA-N |
Molecular Weight |
422.493 g/mol |
SMILES |
OC1(C(C(C(C(OC(C)(C)C)=O)C(C1)=O)c1cc(F)ccc1)C(OC(C)(C)C)=O)C |
SPLASH |
splash10-0a4l-9120000000-885405a13552a70d705b |
Synonyms |
Di(tert-butyl) 2-(3-fluorophenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate
ditert-butyl 2-(3-fluorophenyl)-4-hydroxy-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate
ditert-butyl 2-(3-fluorophenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate
2-(3-fluorophenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid ditert-butyl ester |
Wiley ID |
1447138 |