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10-(1-ADAMANTYL)-2,3,7,8,12,13,17,18-OCTAMETHYL-1,10,19,21,23,24-HEXAHYDRO-1,19-DIOXOBILIN
SpectraBase Compound ID JF15SZvb5hu
InChI InChI=1S/C37H46N4O2/c1-17-21(5)33(38-28(17)12-30-19(3)23(7)35(42)40-30)32(37-14-25-9-26(15-37)11-27(10-25)16-37)34-22(6)18(2)29(39-34)13-31-20(4)24(8)36(43)41-31/h12-13,25-27,32,38-39H,9-11,14-16H2,1-8H3,(H,40,42)(H,41,43)/b30-12-,31-13-/t25-,26+,27-,37-
InChIKey KLFIVTJCTKEQMP-ZJPAWSROSA-N
Mol Weight 578.8 g/mol
Molecular Formula C37H46N4O2
Exact Mass 578.362077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3UDkGC5nR1
Name 10-(1-ADAMANTYL)-2,3,7,8,12,13,17,18-OCTAMETHYL-1,10,19,21,23,24-HEXAHYDRO-1,19-DIOXOBILIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H46N4O2
InChI InChI=1S/C37H46N4O2/c1-17-21(5)33(38-28(17)12-30-19(3)23(7)35(42)40-30)32(37-14-25-9-26(15-37)11-27(10-25)16-37)34-22(6)18(2)29(39-34)13-31-20(4)24(8)36(43)41-31/h12-13,25-27,32,38-39H,9-11,14-16H2,1-8H3,(H,40,42)(H,41,43)/b30-12-,31-13-/t25-,26+,27-,37-
InChIKey KLFIVTJCTKEQMP-ZJPAWSROSA-N
Literature Reference Author A.K.KAR,D.A.LIGHTNER
Literature Reference Citation J.HETCYCL.CHEM.,35,795(1998)
Literature Reference DOI 10.1002/jhet.5570350404
Molecular Weight 578.798 g/mol
Solvent DMSO-D6
Source File Reference UWRU5786