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anti-15-tert-Bytoxy-5,6,7,8-tetrachloropentacyclo[10.2.1(3,10).0(2,11).0(4,9)]hexadeca-4(9),5,7-triene
SpectraBase Compound ID 8f3kRSeh4hd
InChI InChI=1S/C20H22Cl4O/c1-20(2,3)25-19-7-4-5-8(19)12-10-6-9(11(7)12)13-14(10)16(22)18(24)17(23)15(13)21/h7-12,19H,4-6H2,1-3H3/t7-,8+,9-,10+,11-,12+,19?
InChIKey GKPTXXLWTXOMAC-QYVSOTLESA-N
Mol Weight 420.2 g/mol
Molecular Formula C20H22Cl4O
Exact Mass 418.042476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 536FPZRk7U3
Name anti-15-tert-Bytoxy-5,6,7,8-tetrachloropentacyclo[10.2.1(3,10).0(2,11).0(4,9)]hexadeca-4(9),5,7-triene
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Formula C20H22Cl4O
InChI InChI=1S/C20H22Cl4O/c1-20(2,3)25-19-7-4-5-8(19)12-10-6-9(11(7)12)13-14(10)16(22)18(24)17(23)15(13)21/h7-12,19H,4-6H2,1-3H3/t7-,8+,9-,10+,11-,12+,19?
InChIKey GKPTXXLWTXOMAC-QYVSOTLESA-N
Molecular Weight 420.207 g/mol
SMILES c12c([C@@]3(C[C@]2([C@]2([C@@]3([C@@]3(C([C@]2(CC3)[H])OC(C)(C)C)[H])[H])[H])[H])[H])c(Cl)c(c(c1Cl)Cl)Cl
SPLASH splash10-0a4i-9210000000-220b8c015ab24fd5002d
Source of Spectrum KC-0-1224-34
Synonyms 16-tert-butoxy-10,11,12,13-tetrachloropentacyclo[6.6.1.1(3,6).0(2,7).0(9,14)]hexadeca-9,11,13-triene anti-15-tert-Butoxy-5,6,7,8-tetrachloropentacyclo[10.2.1(3,10).0(2,11).0(4,9)]hexadeca-4(9),5,7-triene tert-Butyl 10,11,12,13-tetrachloropentacyclo[6.6.1.1(3,6).0(2,7).0(9,14)]hexadeca-9,11,13-trien-16-yl ether
Wiley ID 821260