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5-NITROFURAN-2-CARBONYL-HOMOPIPERAZINE-PENTA-CYCLOUNDECANE

View entire compound with spectra: 1 NMR

5-NITROFURAN-2-CARBONYL-HOMOPIPERAZINE-PENTA-CYCLOUNDECANE
SpectraBase Compound ID K84D0B3RChu
InChI InChI=1S/C35H42N6O9/c42-32(22-3-5-24(48-22)40(44)45)38-11-1-9-36(15-17-38)13-7-34-28-20-19-21-27-26(20)30(34)31(27)35(50-34,29(21)28)8-14-37-10-2-12-39(18-16-37)33(43)23-4-6-25(49-23)41(46)47/h3-6,20-21,26-31H,1-2,7-19H2/t20-,21+,26-,27+,28+,29-,30-,31+,34-,35+
InChIKey DRTLIADIDAPTHJ-QUENXZOUSA-N
Mol Weight 690.8 g/mol
Molecular Formula C35H42N6O9
Exact Mass 690.301327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ksof5um5Qmq
Name 5-NITROFURAN-2-CARBONYL-HOMOPIPERAZINE-PENTA-CYCLOUNDECANE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H42N6O9
InChI InChI=1S/C35H42N6O9/c42-32(22-3-5-24(48-22)40(44)45)38-11-1-9-36(15-17-38)13-7-34-28-20-19-21-27-26(20)30(34)31(27)35(50-34,29(21)28)8-14-37-10-2-12-39(18-16-37)33(43)23-4-6-25(49-23)41(46)47/h3-6,20-21,26-31H,1-2,7-19H2/t20-,21+,26-,27+,28+,29-,30-,31+,34-,35+
InChIKey DRTLIADIDAPTHJ-QUENXZOUSA-N
Literature Reference Author O.K.ONAJOLE,T.GOVENDER,M.MAKATINI,H.G.KRUGER
Literature Reference Citation MAGN.RES.CHEM.,46,1007(2008)
Literature Reference DOI 10.1002/mrc.2305
Molecular Weight 690.753 g/mol
Solvent CDCl3
Source File Reference UWBT16346