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4-CASCADE:ADIPIC-ACID-[2-1,8]:(1-AZABUTYLIDENE):TERT.-BUTYL-PROPYLESTER
SpectraBase Compound ID JcMLDzQ1PV5
InChI InChI=1S/C40H72N2O12/c1-37(2,3)51-33(45)19-25-41(26-20-34(46)52-38(4,5)6)23-15-29-49-31(43)17-13-14-18-32(44)50-30-16-24-42(27-21-35(47)53-39(7,8)9)28-22-36(48)54-40(10,11)12/h13-30H2,1-12H3
InChIKey SEDJONQHSBGLDL-UHFFFAOYSA-N
Mol Weight 773.0 g/mol
Molecular Formula C40H72N2O12
Exact Mass 772.508526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1f1QHQMU2vu
Name 4-CASCADE:ADIPIC-ACID-[2-1,8]:(1-AZABUTYLIDENE):TERT.-BUTYL-PROPYLESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H72N2O12
InChI InChI=1S/C40H72N2O12/c1-37(2,3)51-33(45)19-25-41(26-20-34(46)52-38(4,5)6)23-15-29-49-31(43)17-13-14-18-32(44)50-30-16-24-42(27-21-35(47)53-39(7,8)9)28-22-36(48)54-40(10,11)12/h13-30H2,1-12H3
InChIKey SEDJONQHSBGLDL-UHFFFAOYSA-N
Literature Reference Author D.SOTO-CASTRO,J.A.CRUZ-MORALES,M.T.R.APAN,P.GUADARRAMA
Literature Reference Citation MOLECULES,15,8082(2010)
Literature Reference DOI 10.3390/molecules15118082
Molecular Weight 773.018 g/mol
Sample ID 72648
Solvent ACETONE-D6