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DI(1-ADAMANTYL) (1-ADAMANTOYL)PHOSPHONATE
SpectraBase Compound ID 53AsLUNKWEt
InChI InChI=1S/C31H45O4P/c32-28(29-10-19-1-20(11-29)3-21(2-19)12-29)36(33,34-30-13-22-4-23(14-30)6-24(5-22)15-30)35-31-16-25-7-26(17-31)9-27(8-25)18-31/h19-27H,1-18H2/t19-,20+,21-,22-,23+,24-,25-,26+,27-,29-,30-,31-
InChIKey HJPUGQMCOUETHY-CLNFXKSMSA-N
Mol Weight 512.7 g/mol
Molecular Formula C31H45O4P
Exact Mass 512.305547 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ERWri7S2Tdo
Name DI(1-ADAMANTYL) (1-ADAMANTOYL)PHOSPHONATE
Comments , ;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H45O4P
InChI InChI=1S/C31H45O4P/c32-28(29-10-19-1-20(11-29)3-21(2-19)12-29)36(33,34-30-13-22-4-23(14-30)6-24(5-22)15-30)35-31-16-25-7-26(17-31)9-27(8-25)18-31/h19-27H,1-18H2/t19-,20+,21-,22-,23+,24-,25-,26+,27-,29-,30-,31-
InChIKey HJPUGQMCOUETHY-CLNFXKSMSA-N
Instrument Name SEE COMMENT
Literature Reference R.I.YURCHENKO, T.I.KLEPA, V.F.BAKLAN, N.A.FOKINA, A.A.KUDRYAVTSEV, V.P.KUKHAR(1992) Zhurn.Obsch.Khim.(Russ. Lang.): v.62, N8, 1760-1764.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6H6 benzene