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[3,5-BIS-(HYDROXYMETHOXYPHOSPHORYLMETHYL)-BENZYL]-PHOSPHORIC-ACID-MONOMETHYLESTER-TRIS-(TETRABUTYLAMMONIUM)-SALT

View entire compound with spectra: 4 NMR

[3,5-BIS-(HYDROXYMETHOXYPHOSPHORYLMETHYL)-BENZYL]-PHOSPHORIC-ACID-MONOMETHYLESTER-TRIS-(TETRABUTYLAMMONIUM)-SALT
SpectraBase Compound ID 8ygpDQIMiwu
InChI InChI=1S/3C16H36N.C12H21O9P3/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-19-22(13,14)7-10-4-11(8-23(15,16)20-2)6-12(5-10)9-24(17,18)21-3/h3*5-16H2,1-4H3;4-6H,7-9H2,1-3H3,(H,13,14)(H,15,16)(H,17,18)/q3*+1;/p-3
InChIKey BHXJULOAYSRDQK-UHFFFAOYSA-K
Mol Weight 1126.6 g/mol
Molecular Formula C60H126N3O9P3
Exact Mass 1125.870694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BSooNAlSfE6
Name 1,3,5-TRIS-(HYDROXYMETHOXYPHOSPHORYLMETHYL)-BENZENE-TRIS-(TETRABUTYLAMMNONIUM)-SALT
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H126N3O9P3
InChI InChI=1S/3C16H36N.C12H21O9P3/c3*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-19-22(13,14)7-10-4-11(8-23(15,16)20-2)6-12(5-10)9-24(17,18)21-3/h3*5-16H2,1-4H3;4-6H,7-9H2,1-3H3,(H,13,14)(H,15,16)(H,17,18)/q3*+1;/p-3
InChIKey BHXJULOAYSRDQK-UHFFFAOYSA-K
Literature Reference Author T.GRWE,T.SCHRADER,R.ZADMARD,A.KRAFT
Literature Reference Citation J.ORG.CHEM.,67,3755(2002)
Literature Reference DOI 10.1021/jo025513y
Molecular Weight 1126.596 g/mol
Solvent CDCl3
Source File Reference UWLU26003