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Dibenzyl 14,19-dihydroxyundecacyclo-icosane-4,9-dicarboxylate
SpectraBase Compound ID 6kqcHVT7y9h
InChI InChI=1S/C36H32O6/c37-29-25-17-18-26(29)34-22-16-15-21(19(22)31(39)41-11-13-7-3-1-4-8-13)33(25,34)35-23(15)20(32(40)42-12-14-9-5-2-6-10-14)24(16)36(34,35)28(18)30(38)27(17)35/h1-10,15-30,37-38H,11-12H2
InChIKey ACKSXLAKCCIKCJ-UHFFFAOYSA-N
Mol Weight 560.6 g/mol
Molecular Formula C36H32O6
Exact Mass 560.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZ15nknfP6g
Name Dibenzyl 14,19-dihydroxyundecacyclo-icosane-4,9-dicarboxylate
Alternate Name(s) dibenzyl 14,19-dihydroxyundecacyclo[9.9.0.0(1,5).0(2,12).0(2,18).0(3,7).0(6,10).0(8,12).0(11,15).0(13,17).0(16,20)]icosane-4,9-dicarboxylate
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Formula C36H32O6
InChI InChI=1S/C36H32O6/c37-29-25-17-18-26(29)34-22-16-15-21(19(22)31(39)41-11-13-7-3-1-4-8-13)33(25,34)35-23(15)20(32(40)42-12-14-9-5-2-6-10-14)24(16)36(34,35)28(18)30(38)27(17)35/h1-10,15-30,37-38H,11-12H2
InChIKey ACKSXLAKCCIKCJ-UHFFFAOYSA-N
Molecular Weight 560.646 g/mol
SMILES OC1C2C3C4C5C67C8(C9C(C%10C28C7(C3C5O)C2C(C6C9C%102)C(OCc2ccccc2)=O)C(OCc2ccccc2)=O)C14
SPLASH splash10-01ox-9000080000-e60feb73832121134412
Source of Spectrum U-1997-2082-16
Wiley ID 770372