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Tetraethyl 1,2,3,4-tetrahydrophenanthrene-2,2,3,3-tetracarboxylate
SpectraBase Compound ID HHoHAyQkVlZ
InChI InChI=1S/C26H30O8/c1-5-31-21(27)25(22(28)32-6-2)15-18-14-13-17-11-9-10-12-19(17)20(18)16-26(25,23(29)33-7-3)24(30)34-8-4/h9-14H,5-8,15-16H2,1-4H3
InChIKey JOUWLYYUAGVSGE-UHFFFAOYSA-N
Mol Weight 470.52 g/mol
Molecular Formula C26H30O8
Exact Mass 470.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4NBhO3wbsCO
Name Tetraethyl 1,2,3,4-tetrahydrophenanthrene-2,2,3,3-tetracarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 470.194067918 u
Formula C26H30O8
InChI InChI=1S/C26H30O8/c1-5-31-21(27)25(22(28)32-6-2)15-18-14-13-17-11-9-10-12-19(17)20(18)16-26(25,23(29)33-7-3)24(30)34-8-4/h9-14H,5-8,15-16H2,1-4H3
InChIKey JOUWLYYUAGVSGE-UHFFFAOYSA-N
Molecular Weight 470.518 g/mol
SMILES C1(C(CC2=C(C1)C1=C(C=C2)C=CC=C1)(C(=O)OCC)C(=O)OCC)(C(=O)OCC)C(=O)OCC