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SODIUM_SALT_OF_9-(2'-HYDROXY-4',4'-DIMETHYL-6'-OXO-1'CYCLOHEXEN-1-YL)-3,3-DIMETHYL-9-H-XANTHEN-1-ONE
SpectraBase Compound ID J4uIRPAYFZH
InChI InChI=1S/C23H26O4.Na/c1-22(2)9-14(24)20(15(25)10-22)19-13-7-5-6-8-17(13)27-18-12-23(3,4)11-16(26)21(18)19;/h5-8,19,24H,9-12H2,1-4H3;/q;+1/p-1
InChIKey UQWMGRXEFFGXKR-UHFFFAOYSA-M
Mol Weight 388.44 g/mol
Molecular Formula C23H25NaO4
Exact Mass 388.165054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3T62Liko4zc
Name SODIUM_SALT_OF_9-(2'-HYDROXY-4',4'-DIMETHYL-6'-OXO-1'CYCLOHEXEN-1-YL)-3,3-DIMETHYL-9-H-XANTHEN-1-ONE
Compound Number VI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H25NaO4
InChI InChI=1S/C23H26O4.Na/c1-22(2)9-14(24)20(15(25)10-22)19-13-7-5-6-8-17(13)27-18-12-23(3,4)11-16(26)21(18)19;/h5-8,19,24H,9-12H2,1-4H3;/q;+1/p-1
InChIKey UQWMGRXEFFGXKR-UHFFFAOYSA-M
Literature Reference Author A.N.PYRKO
Literature Reference Citation CHEM.HET.COMP.,32,635(1996)
Literature Reference DOI 10.1007/bf01164861
Molecular Weight 388.439 g/mol
Solvent CD3OD
Source File Reference UWMZ13867