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Dibenzofuran, 2,3,6(or 3,4,6)-trimethoxy-4,7(or 2,7)-dipentadecyl-
SpectraBase Compound ID 9SQC5WT5vH8
InChI InChI=1S/C45H74O4/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-37-34-35-39-40-36-38(33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)42(47-4)45(48-5)44(40)49-43(39)41(37)46-3/h34-36H,6-33H2,1-5H3
InChIKey RWBNQYTXYTUUIQ-UHFFFAOYSA-N
Mol Weight 679.1 g/mol
Molecular Formula C45H74O4
Exact Mass 678.558711 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JidLbQctCeT
Name Dibenzofuran, 2,3,6(or 3,4,6)-trimethoxy-4,7(or 2,7)-dipentadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 678.558710859 u
Formula C45H74O4
InChI InChI=1S/C45H74O4/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-37-34-35-39-40-36-38(33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)42(47-4)45(48-5)44(40)49-43(39)41(37)46-3/h34-36H,6-33H2,1-5H3
InChIKey RWBNQYTXYTUUIQ-UHFFFAOYSA-N
Molecular Weight 679.083 g/mol
SMILES C=12C(C3=CC=C(C(=C3O2)OC)CCCCCCCCCCCCCCC)=CC(=C(C1OC)OC)CCCCCCCCCCCCCCC