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ORTHO-(3-(2'-((ORTHO'-CYANO-[(13)-CN]-METHYL)-PHENYL)-METHOXY)-ETHOXYLPROPYL)-PHENYL-PHENYL-METHYL-PHOSPHINATE
SpectraBase Compound ID A7PHC8jKPQH
InChI InChI=1S/C27H30NO4P/c1-30-33(29,26-14-3-2-4-15-26)27-16-8-7-11-24(27)13-9-19-31-20-21-32-22-25-12-6-5-10-23(25)17-18-28/h2-8,10-12,14-16H,9,13,17,19-22H2,1H3/i18+1
InChIKey UNZIWIDIKSWUHS-CPZJZEHKSA-N
Mol Weight 464.51 g/mol
Molecular Formula C2613CH30NO4P
Exact Mass 464.1946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3gZ1UC0Lvcx
Name ORTHO-(3-(2'-((ORTHO'-CYANO-[(13)-CN]-METHYL)-PHENYL)-METHOXY)-ETHOXYLPROPYL)-PHENYL-PHENYL-METHYL-PHOSPHINATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C2613CH30NO4P
InChI InChI=1S/C27H30NO4P/c1-30-33(29,26-14-3-2-4-15-26)27-16-8-7-11-24(27)13-9-19-31-20-21-32-22-25-12-6-5-10-23(25)17-18-28/h2-8,10-12,14-16H,9,13,17,19-22H2,1H3/i18+1
InChIKey UNZIWIDIKSWUHS-CPZJZEHKSA-N
Literature Reference Author P.BEAK,K.C.BASU,J.J.LI
Literature Reference Citation J.ORG.CHEM.,64,5218(1999)
Literature Reference DOI 10.1021/jo990509g
Molecular Weight 464.506 g/mol
Sample ID 41204
Solvent CDCl3