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3,6,10,13-Tetraoxabicyclo[13.3.1]nonadeca-1(19),15,17-trien-8-ol, 19-methoxy-17-methyl-, 4-methylbenzenesulfonate
SpectraBase Compound ID 8GHkgeyceuM
InChI InChI=1S/C24H32O8S/c1-18-4-6-23(7-5-18)33(25,26)32-22-16-30-10-8-28-14-20-12-19(2)13-21(24(20)27-3)15-29-9-11-31-17-22/h4-7,12-13,22H,8-11,14-17H2,1-3H3
InChIKey DEUKQLNWMUHSHB-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C24H32O8S
Exact Mass 480.181789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Yah8FfeFTQ
Name 3,6,10,13-Tetraoxabicyclo[13.3.1]nonadeca-1(19),15,17-trien-8-ol, 19-methoxy-17-methyl-, 4-methylbenzenesulfonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 480.181789156 u
Formula C24H32O8S
InChI InChI=1S/C24H32O8S/c1-18-4-6-23(7-5-18)33(25,26)32-22-16-30-10-8-28-14-20-12-19(2)13-21(24(20)27-3)15-29-9-11-31-17-22/h4-7,12-13,22H,8-11,14-17H2,1-3H3
InChIKey DEUKQLNWMUHSHB-UHFFFAOYSA-N
Molecular Weight 480.572 g/mol
SMILES C1(OS(C=2C=CC(=CC2)C)(=O)=O)COCCOCC2=CC(=CC(COCCOC1)=C2OC)C