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2,2',2-TRI(2,4,8,10-TETRA-TERT-BUTYL-12H-DIBENZO[D,G][1,3,2]DIOXAPHOSPHOCIN-6-YL-6-OXY)TRIETHYLAMINE
SpectraBase Compound ID 6PoTcxLIahD
InChI InChI=1S/C93H138NO9P3/c1-82(2,3)64-46-58-43-59-47-65(83(4,5)6)53-71(89(22,23)24)77(59)99-104(98-76(58)70(52-64)88(19,20)21)95-40-37-94(38-41-96-105-100-78-60(48-66(84(7,8)9)54-72(78)90(25,26)27)44-61-49-67(85(10,11)12)55-73(79(61)101-105)91(28,29)30)39-42-97-106-102-80-62(50-68(86(13,14)15)56-74(80)92(31,32)33)45-63-51-69(87(16,17)18)57-75(81(63)103-106)93(34,35)36/h46-57H,37-45H2,1-36H3
InChIKey QIRHZDPJGLOSJP-UHFFFAOYSA-N
Mol Weight 1507.0 g/mol
Molecular Formula C93H138NO9P3
Exact Mass 1505.958446 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8NChvlhKgZP
Name 2,2',2-TRI(2,4,8,10-TETRA-TERT-BUTYL-12H-DIBENZO[D,G][1,3,2]DIOXAPHOSPHOCIN-6-YL-6-OXY)TRIETHYLAMINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C93H138NO9P3
InChI InChI=1S/C93H138NO9P3/c1-82(2,3)64-46-58-43-59-47-65(83(4,5)6)53-71(89(22,23)24)77(59)99-104(98-76(58)70(52-64)88(19,20)21)95-40-37-94(38-41-96-105-100-78-60(48-66(84(7,8)9)54-72(78)90(25,26)27)44-61-49-67(85(10,11)12)55-73(79(61)101-105)91(28,29)30)39-42-97-106-102-80-62(50-68(86(13,14)15)56-74(80)92(31,32)33)45-63-51-69(87(16,17)18)57-75(81(63)103-106)93(34,35)36/h46-57H,37-45H2,1-36H3
InChIKey QIRHZDPJGLOSJP-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference P.A.ODORISIO, S.D.PASTOR, J.D.SPIVACK (1984) Phosphorus and Sulfur: v.19, N1, 1-10.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d