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15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol, triacetate
SpectraBase Compound ID BvFdKChuaM3
InChI InChI=1S/C27H32O8/c1-16(28)33-21-9-7-6-8-20-15-23(26(35-18(3)30)27(32-5)25(20)31-4)22-14-19(10-12-21)11-13-24(22)34-17(2)29/h11,13-15,21H,6-10,12H2,1-5H3
InChIKey SPNHJRZHPJEMBR-UHFFFAOYSA-N
Mol Weight 484.5 g/mol
Molecular Formula C27H32O8
Exact Mass 484.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BzGu6CDj3WU
Name 15,16-Dimethoxytricyclo[12.3.1.12,6]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,17-triol, triacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 484.209717982 u
Formula C27H32O8
InChI InChI=1S/C27H32O8/c1-16(28)33-21-9-7-6-8-20-15-23(26(35-18(3)30)27(32-5)25(20)31-4)22-14-19(10-12-21)11-13-24(22)34-17(2)29/h11,13-15,21H,6-10,12H2,1-5H3
InChIKey SPNHJRZHPJEMBR-UHFFFAOYSA-N
Molecular Weight 484.545 g/mol
SMILES C12=C(C(=C(C(=C2)C2=C(C=CC(=C2)CCC(CCCC1)OC(=O)C)OC(=O)C)OC(=O)C)OC)OC