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3,6-DIETHOXY-2-[1-(DIETHOXYPHOSPHORYL)-1-ETHOXYCARBONYL-2-PHENYLETHYL]-2,5-DIHYDRO-5-ISOPROPYLPYRAZINE;MIXTURE
SpectraBase Compound ID KiroK1myTCj
InChI InChI=1S/C52H80N4O14P2/c1-15-61-46-41(34(11)12)53-47(62-16-2)43(54-46)39(44(49(57)64-18-4)71(59,67-21-7)68-22-8)37-32-28-29-33-38(37)52(51(66-20-6)55-42(35(13)14)48(56-52)63-17-3)40(36-30-26-25-27-31-36)45(50(58)65-19-5)72(60,69-23-9)70-24-10/h25-35,39-45H,15-24H2,1-14H3
InChIKey RWEYVOYIFSLJQA-UHFFFAOYSA-N
Mol Weight 1047.2 g/mol
Molecular Formula C52H80N4O14P2
Exact Mass 1046.514627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8K0ZlPRLq78
Name 3,6-DIETHOXY-2-[1-(DIETHOXYPHOSPHORYL)-1-ETHOXYCARBONYL-2-PHENYLETHYL]-2,5-DIHYDRO-5-ISOPROPYLPYRAZINE;MIXTURE
Compound Number 16AHM/17AHM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H80N4O14P2
InChI InChI=1S/C52H80N4O14P2/c1-15-61-46-41(34(11)12)53-47(62-16-2)43(54-46)39(44(49(57)64-18-4)71(59,67-21-7)68-22-8)37-32-28-29-33-38(37)52(51(66-20-6)55-42(35(13)14)48(56-52)63-17-3)40(36-30-26-25-27-31-36)45(50(58)65-19-5)72(60,69-23-9)70-24-10/h25-35,39-45H,15-24H2,1-14H3
InChIKey RWEYVOYIFSLJQA-UHFFFAOYSA-N
Literature Reference Author M.RUIZ,M.C.FERNANDEZ,A.DIAZ,J.M.QUINTELA,V.OJEA
Literature Reference Citation J.ORG.CHEM.,68,7634(2003)
Literature Reference DOI 10.1021/jo034707q
Molecular Weight 1047.173 g/mol
Solvent CDCl3
Source File Reference UWSI23119