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all-syn-Decacyclo[10.10.2.2(3,10).2(5,8).2(14,21).2(16,19).0(2,11).0(4,9).0(13,22).0(15,20)]dotriaconta-6,17,23,25,27-pentaene
SpectraBase Compound ID 5rWHcfzeIoY
InChI InChI=1S/C32H36/c1-2-16-4-3-15(1)25-19-9-10-20(26(16)25)30-24-14-13-23(29(19)30)31-21-11-12-22(32(24)31)28-18-7-5-17(6-8-18)27(21)28/h1-2,5,7,9-32H,3-4,6,8H2/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24+,25+,26-,27-,28+,29+,30-,31+,32-
InChIKey NYEAZPALXJYHFU-KKIRDCFWSA-N
Mol Weight 420.6 g/mol
Molecular Formula C32H36
Exact Mass 420.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jq3UiDNSRyT
Name all-syn-Decacyclo[10.10.2.2(3,10).2(5,8).2(14,21).2(16,19).0(2,11).0(4,9).0(13,22).0(15,20)]dotriaconta-6,17,23,25,27-pentaene
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Formula C32H36
InChI InChI=1S/C32H36/c1-2-16-4-3-15(1)25-19-9-10-20(26(16)25)30-24-14-13-23(29(19)30)31-21-11-12-22(32(24)31)28-18-7-5-17(6-8-18)27(21)28/h1-2,5,7,9-32H,3-4,6,8H2/t15-,16+,17+,18-,19-,20+,21-,22+,23-,24+,25+,26-,27-,28+,29+,30-,31+,32-
InChIKey NYEAZPALXJYHFU-KKIRDCFWSA-N
Molecular Weight 420.640 g/mol
SMILES [C@@]12([C@@]([C@]3([C@@]4([C@]([C@@]2(C=C3)[H])([C@]2([C@]3([C@]([C@]5(C=C[C@@]3(CC5)[H])[H])([C@@]4(C=C2)[H])[H])[H])[H])[H])[H])[H])([C@]2(C=C[C@@]1([C@@]1([C@]2([C@@]2(C=C[C@]1(CC2)[H])[H])[H])[H])[H])[H])[H])[H]
SPLASH splash10-004i-9000000000-d50c12821378bcb9e789
Source of Spectrum KC-0-1898-29
Synonyms decacyclo[10.10.2.2(3,10).2(5,8).2(14,21).2(16,19).0(2,11).0(4,9).0(13,22).0(15,20)]dotriaconta-6,17,23,25,29-pentaene
Wiley ID 825270