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8,19-Diacetoxy-(7.alpha.,9.alpha.,18.alpha.,20.alpha.)-7,9,18,20-tetrahydro-7,20:9,18-dimethanononacene
SpectraBase Compound ID 7QLYIFSYx2L
InChI InChI=1S/C44H30O4/c1-21(45)47-43-39-35-19-37(33-17-29-13-25-9-5-3-7-23(25)11-27(29)15-31(33)35)41(39)44(48-22(2)46)42-38-20-36(40(42)43)32-16-28-12-24-8-4-6-10-26(24)14-30(28)18-34(32)38/h3-18,35-38H,19-20H2,1-2H3
InChIKey YIUYGSQSKLTRCH-UHFFFAOYSA-N
Mol Weight 622.7 g/mol
Molecular Formula C44H30O4
Exact Mass 622.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78ynxtxpJ9j
Name 8,19-Diacetoxy-(7.alpha.,9.alpha.,18.alpha.,20.alpha.)-7,9,18,20-tetrahydro-7,20:9,18-dimethanononacene
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Formula C44H30O4
InChI InChI=1S/C44H30O4/c1-21(45)47-43-39-35-19-37(33-17-29-13-25-9-5-3-7-23(25)11-27(29)15-31(33)35)41(39)44(48-22(2)46)42-38-20-36(40(42)43)32-16-28-12-24-8-4-6-10-26(24)14-30(28)18-34(32)38/h3-18,35-38H,19-20H2,1-2H3
InChIKey YIUYGSQSKLTRCH-UHFFFAOYSA-N
Molecular Weight 622.720 g/mol
SMILES c12c(C3CC1c1c3cc3c(c1)cc1c(cccc1)c3)c(OC(=O)C)c1c(c2OC(=O)C)C2c3c(cc4c(c3)cc3c(cccc3)c4)C1C2
SPLASH splash10-00di-0000059000-952d0df52b84a4416592
Source of Spectrum QE-11-3373-1
Synonyms 22-(acetyloxy)undecacyclo[22.14.1.1(5,20).0(2,23).0(4,21).0(6,19).0(8,17).0(10,15).0(25,38).0(27,36).0(29,34)]tetraconta-2(23),3,6,8,10,12,14,16,18,21,25(38),26,28,30,32,34,36-heptadecaen-3-yl acetate
Wiley ID 1638768