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HEXAKIS-[4-[(1)-N-PROPANOYLOXYETHANEIMIDOYL]-PHENOXY]-CYCLOTRIPHOSPHEZANE
SpectraBase Compound ID 7ebvFW6CeaG
InChI InChI=1S/C66H72N9O18P3/c1-13-61(76)82-67-43(7)49-19-31-55(32-20-49)88-94(89-56-33-21-50(22-34-56)44(8)68-83-62(77)14-2)73-95(90-57-35-23-51(24-36-57)45(9)69-84-63(78)15-3,91-58-37-25-52(26-38-58)46(10)70-85-64(79)16-4)75-96(74-94,92-59-39-27-53(28-40-59)47(11)71-86-65(80)17-5)93-60-41-29-54(30-42-60)48(12)72-87-66(81)18-6/h19-42H,13-18H2,1-12H3/b67-43-,68-44-,69-45-,70-46-,71-47-,72-48-
InChIKey GQVLYSCZMCANSB-ZTAVLCNTSA-N
Mol Weight 1372.3 g/mol
Molecular Formula C66H72N9O18P3
Exact Mass 1371.420817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IFEqJU3ge9W
Name HEXAKIS-[4-[(1)-N-PROPANOYLOXYETHANEIMIDOYL]-PHENOXY]-CYCLOTRIPHOSPHEZANE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H72N9O18P3
InChI InChI=1S/C66H72N9O18P3/c1-13-61(76)82-67-43(7)49-19-31-55(32-20-49)88-94(89-56-33-21-50(22-34-56)44(8)68-83-62(77)14-2)73-95(90-57-35-23-51(24-36-57)45(9)69-84-63(78)15-3,91-58-37-25-52(26-38-58)46(10)70-85-64(79)16-4)75-96(74-94,92-59-39-27-53(28-40-59)47(11)71-86-65(80)17-5)93-60-41-29-54(30-42-60)48(12)72-87-66(81)18-6/h19-42H,13-18H2,1-12H3/b67-43-,68-44-,69-45-,70-46-,71-47-,72-48-
InChIKey GQVLYSCZMCANSB-ZTAVLCNTSA-N
Literature Reference Author E.CIL,M.ARSLAN,A.O.GOERGUELUE
Literature Reference Citation CAN.J.CHEM.,83,2039(2005)
Literature Reference DOI 10.1139/v05-223
Molecular Weight 1372.268 g/mol
Solvent DMSO-D6
Source File Reference UWLU30355