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BICADINANE
SpectraBase Compound ID DKZHN56XbXY
InChI InChI=1S/C30H52/c1-17(2)22-9-8-20(6)24-15-25-21(14-26(22)24)16-30(7)11-10-23(18(3)4)27-12-19(5)13-28(25)29(27)30/h17-29H,8-16H2,1-7H3/t19-,20+,21+,22-,23-,24-,25-,26-,27?,28?,29-,30-/m0/s1
InChIKey PTJNNBKAZKHNHT-VELYDPBNSA-N
Mol Weight 412.7 g/mol
Molecular Formula C30H52
Exact Mass 412.406902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9YwdJIaYybt
Name BICADINANE
Compound Number 391
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52
InChI InChI=1S/C30H52/c1-17(2)22-9-8-20(6)24-15-25-21(14-26(22)24)16-30(7)11-10-23(18(3)4)27-12-19(5)13-28(25)29(27)30/h17-29H,8-16H2,1-7H3/t19-,20+,21+,22-,23-,24-,25-,26-,27?,28?,29-,30-/m0/s1
InChIKey PTJNNBKAZKHNHT-VELYDPBNSA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 412.743 g/mol
Solvent CDCl3
Source File Reference UWMS5491