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Dibenzocentro-hexaquinane
SpectraBase Compound ID 7moGmEreBPC
InChI InChI=1S/C25H24/c1-3-7-19-17(5-1)22-12-9-21-10-13-23(15-14-22)18-6-2-4-8-20(18)24(19,16-11-21)25(21,22)23/h1-8H,9-16H2/t21?,22-,23+,24-,25+
InChIKey MJTROZCODSFHIN-NZSVOSDMSA-N
Mol Weight 324.47 g/mol
Molecular Formula C25H24
Exact Mass 324.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WBSq7xMKwe
Name Dibenzocentro-hexaquinane
Alternate Name(s) (1S,8R,14S,25R)-octacyclo[9.9.2.2(8,14).1(1,8).0(2,7).0(15,20).0(11,25).0(14,25)]pentacosa-2(7),3,5,15(20),16,18-hexaene
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Formula C25H24
InChI InChI=1S/C25H24/c1-3-7-19-17(5-1)22-12-9-21-10-13-23(15-14-22)18-6-2-4-8-20(18)24(19,16-11-21)25(21,22)23/h1-8H,9-16H2/t21?,22-,23+,24-,25+
InChIKey MJTROZCODSFHIN-NZSVOSDMSA-N
Molecular Weight 324.467 g/mol
SMILES [C@]123[C@@]45c6ccccc6[C@@]33CC[C@]1(c1ccccc51)CCC2(CC3)CC4
SPLASH splash10-00di-0049000000-65fe79887126dd16eefb
Source of Spectrum U-1996-1358-10
Wiley ID 768604