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Terphenyllin, 3ac derivative
SpectraBase Compound ID 4j2Emrm6mt2
InChI InChI=1S/C26H24O8/c1-15(27)32-20-10-6-18(7-11-20)22-14-23(30-4)24(26(25(22)31-5)34-17(3)29)19-8-12-21(13-9-19)33-16(2)28/h6-14H,1-5H3
InChIKey URTLNVPAJMHHMA-UHFFFAOYSA-N
Mol Weight 464.47 g/mol
Molecular Formula C26H24O8
Exact Mass 464.147118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaUIwWdYq3C
Name Terphenyllin, 3ac derivative
Comments Computed using HOSE algorithm
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Exact Mass 464.147117725 u
Formula C26H24O8
InChI InChI=1S/C26H24O8/c1-15(27)32-20-10-6-18(7-11-20)22-14-23(30-4)24(26(25(22)31-5)34-17(3)29)19-8-12-21(13-9-19)33-16(2)28/h6-14H,1-5H3
InChIKey URTLNVPAJMHHMA-UHFFFAOYSA-N
Molecular Weight 464.470 g/mol
SMILES C1(OC(=O)C)=CC=C(C=C1)C=1C(=C(OC(=O)C)C(=C(OC)C1)C=1C=CC(OC(=O)C)=CC1)OC