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1H-Xanthene-2,9-dione, 6(or 8)-(acetyloxy)-3,4-dihydro-8(or 6)-hydroxy-1,1,7-tris(3-methyl-2-butenyl)-
SpectraBase Compound ID 6nU3KPhmkH1
InChI InChI=1S/C30H36O6/c1-17(2)8-9-21-23(35-20(7)31)16-24-26(28(21)33)29(34)27-22(36-24)10-11-25(32)30(27,14-12-18(3)4)15-13-19(5)6/h8,12-13,16,33H,9-11,14-15H2,1-7H3
InChIKey GOSUUHXIYPJBIC-UHFFFAOYSA-N
Mol Weight 492.6 g/mol
Molecular Formula C30H36O6
Exact Mass 492.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4V3xjkkRGvX
Name 1H-Xanthene-2,9-dione, 6(or 8)-(acetyloxy)-3,4-dihydro-8(or 6)-hydroxy-1,1,7-tris(3-methyl-2-butenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.251188873 u
Formula C30H36O6
InChI InChI=1S/C30H36O6/c1-17(2)8-9-21-23(35-20(7)31)16-24-26(28(21)33)29(34)27-22(36-24)10-11-25(32)30(27,14-12-18(3)4)15-13-19(5)6/h8,12-13,16,33H,9-11,14-15H2,1-7H3
InChIKey GOSUUHXIYPJBIC-UHFFFAOYSA-N
Molecular Weight 492.612 g/mol
SMILES C1=2C(C3=C(C(CC=C(C)C)=C(C=C3OC2CCC(C1(CC=C(C)C)CC=C(C)C)=O)OC(=O)C)O)=O