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Diethyl 4-hydroxy-2-(4-hydroxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate
SpectraBase Compound ID CvRSWDvKXnH
InChI InChI=1S/C19H24O7/c1-4-25-17(22)15-13(21)10-19(3,24)16(18(23)26-5-2)14(15)11-6-8-12(20)9-7-11/h6-9,14-16,20,24H,4-5,10H2,1-3H3
InChIKey DBLPGZGDTKTZTB-UHFFFAOYSA-N
Mol Weight 364.39 g/mol
Molecular Formula C19H24O7
Exact Mass 364.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hq4EcwrG7lH
Name Diethyl 4-hydroxy-2-(4-hydroxyphenyl)-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 364.152203106 u
Formula C19H24O7
InChI InChI=1S/C19H24O7/c1-4-25-17(22)15-13(21)10-19(3,24)16(18(23)26-5-2)14(15)11-6-8-12(20)9-7-11/h6-9,14-16,20,24H,4-5,10H2,1-3H3
InChIKey DBLPGZGDTKTZTB-UHFFFAOYSA-N
Molecular Weight 364.394 g/mol
SMILES OC1(CC(C(C(C2=CC=C(C=C2)O)C1C(=O)OCC)C(=O)OCC)=O)C