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2,4,12-tris(1',1'-Dimethylpropyl)-1,3,13-triphosphatetracyclo[6.2.2.1(6,9).0(5,10)]trideca-2,12-diene
SpectraBase Compound ID 5OBARaR12Cs
InChI InChI=1S/C25H43P3/c1-10-22(4,5)20-26-25(24(8,9)12-3)18-16-13-14-17(15-16)19(18)28(20)21(27-25)23(6,7)11-2/h16-19H,10-15H2,1-9H3/t16-,17+,18-,19+,25-,28?/m0/s1
InChIKey JWCHRCKCESNUBH-GYMHSGPUSA-N
Mol Weight 436.5 g/mol
Molecular Formula C25H43P3
Exact Mass 436.257762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALbHkLCo2sQ
Name 2,4,12-tris(1',1'-Dimethylpropyl)-1,3,13-triphosphatetracyclo[6.2.2.1(6,9).0(5,10)]trideca-2,12-diene
Alternate Name(s) 8,10,11-tritert-pentyl-1,9,12-triphosphatetracyclo[6.2.2.1(3,6).0(2,7)]trideca-9,11-diene
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Formula C25H43P3
InChI InChI=1S/C25H43P3/c1-10-22(4,5)20-26-25(24(8,9)12-3)18-16-13-14-17(15-16)19(18)28(20)21(27-25)23(6,7)11-2/h16-19H,10-15H2,1-9H3/t16-,17+,18-,19+,25-,28?/m0/s1
InChIKey JWCHRCKCESNUBH-GYMHSGPUSA-N
Molecular Weight 436.540 g/mol
SMILES [C@]12(P=C(C(CC)(C)C)[P@]([C@]3([C@@]2([C@@]2(C[C@]3(CC2)[H])[H])[H])[H])C(=P1)C(CC)(C)C)C(CC)(C)C
SPLASH splash10-08fs-0964600000-faa8c2b791da62eec8e0
Source of Spectrum K1-2001-3432-15
Wiley ID 814390