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10-OXOCANCENTRINE

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10-OXOCANCENTRINE
SpectraBase Compound ID IJPmDdqLXud
InChI InChI=1S/C36H32N2O8/c1-37-14-12-35-19-15-36(34(35)46-32-22(44-4)10-7-18(25(32)35)28(39)26(19)37)33(41)24-17-6-9-20(42-2)29(40)30(17)45-31-21(43-3)8-5-16-11-13-38(36)27(24)23(16)31/h5-10,19,26,34,40H,11-15H2,1-4H3/t19?,26-,34?,35-,36?/m1/s1
InChIKey LKYZUDKLMJMIDF-LHBFSMIGSA-N
Mol Weight 620.7 g/mol
Molecular Formula C36H32N2O8
Exact Mass 620.215866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQseKOY7cRX
Name 10-OXO-CANCENTRINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H32N2O8
InChI InChI=1S/C36H32N2O8/c1-37-14-12-35-19-15-36(34(35)46-32-22(44-4)10-7-18(25(32)35)28(39)26(19)37)33(41)24-17-6-9-20(42-2)29(40)30(17)45-31-21(43-3)8-5-16-11-13-38(36)27(24)23(16)31/h5-10,19,26,34,40H,11-15H2,1-4H3/t19?,26-,34?,35-,36?/m1/s1
InChIKey LKYZUDKLMJMIDF-LHBFSMIGSA-N
Literature Reference Author H.L.HOLLAND,D.W.HUGHES,D.B.MACLEAN,R.G.A.RODRIGO
Literature Reference Citation CAN.J.CHEM.,56,2467(1978)
Literature Reference DOI 10.1139/v78-403
Molecular Weight 620.659 g/mol
Solvent CDCl3
Source File Reference UWED1724