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3,17-DIISOPROPYL-6,7,8,9,10,11,12,13,20,21,22,23,24,25,26,27-HEXADECAHYDRODICYCLOHEPTA-[B,M]-[1,4,12,15]-TETRAAZACYCLODOCOSINE
SpectraBase Compound ID 9WaNBVjpNRa
InChI InChI=1S/C34H52N4/c1-27(2)29-15-19-31-32(20-16-29)36-24-12-8-6-10-14-26-38-34-22-18-30(28(3)4)17-21-33(34)37-25-13-9-5-7-11-23-35-31/h15-22,27-28,35,38H,5-14,23-26H2,1-4H3/b36-32-,37-33-
InChIKey QAVIILYHJXYAKN-QAIJNKCPSA-N
Mol Weight 516.8 g/mol
Molecular Formula C34H52N4
Exact Mass 516.419198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GY3xTC6X6zd
Name 3,17-DIISOPROPYL-6,7,8,9,10,11,12,13,20,21,22,23,24,25,26,27-HEXADECAHYDRODICYCLOHEPTA-[B,M]-[1,4,12,15]-TETRAAZACYCLODOCOSINE
Compound Number 4F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H52N4
InChI InChI=1S/C34H52N4/c1-27(2)29-15-19-31-32(20-16-29)36-24-12-8-6-10-14-26-38-34-22-18-30(28(3)4)17-21-33(34)37-25-13-9-5-7-11-23-35-31/h15-22,27-28,35,38H,5-14,23-26H2,1-4H3/b36-32-,37-33-
InChIKey QAVIILYHJXYAKN-QAIJNKCPSA-N
Literature Reference Author K.SHINDO,L.C.ZHANG,H.WAKABAYASHI,H.MIYAMAE,S.ISHIKAWA,T.NOZO E
Literature Reference Citation HETEROCYCLES,40,913(1995)
Literature Reference DOI 10.3987/COM-94-S91
Molecular Weight 516.814 g/mol
Solvent CDCl3
Source File Reference UWCP2644