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MJVDRQYFUJOQDB-UHFFFAOYSA-N

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MJVDRQYFUJOQDB-UHFFFAOYSA-N
SpectraBase Compound ID 36rLly2fHrO
InChI InChI=1S/C22H32ClN4O9P/c1-13-18(27-21(31)35-22(2,3)4)20(30)25-10-17(28)26-16(19(29)24-5)12-34-37(32,36-13)33-11-14-6-8-15(23)9-7-14/h6-9,13,16,18H,10-12H2,1-5H3,(H,24,29)(H,25,30)(H,26,28)(H,27,31)
InChIKey MJVDRQYFUJOQDB-UHFFFAOYSA-N
Mol Weight 562.9 g/mol
Molecular Formula C22H32ClN4O9P
Exact Mass 562.159543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GfsOqWBHqpi
Name MJVDRQYFUJOQDB-UHFFFAOYSA-N
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32ClN4O9P
InChI InChI=1S/C22H32ClN4O9P/c1-13-18(27-21(31)35-22(2,3)4)20(30)25-10-17(28)26-16(19(29)24-5)12-34-37(32,36-13)33-11-14-6-8-15(23)9-7-14/h6-9,13,16,18H,10-12H2,1-5H3,(H,24,29)(H,25,30)(H,26,28)(H,27,31)
InChIKey MJVDRQYFUJOQDB-UHFFFAOYSA-N
Literature Reference Author A.H.VANOIJEN,S.BEHRENS,D.F.MIERKE,H.KESSLER,J.H.VANBOOM,R.M. J.LISKAMP
Literature Reference Citation J.ORG.CHEM.,58,3722(1993)
Literature Reference DOI 10.1021/jo00066a026
Molecular Weight 562.944 g/mol
Solvent CDCl3
Source File Reference UWCS19278