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1,-t-2-Bis(3,4,5-Trimethoxyphenyl)-c-3,t-4-bis(3,4-methylenedioxyphenyl)-r-1,c-2-cyclobutanedinitrile
SpectraBase Compound ID DqcBj6KSX0y
InChI InChI=1S/C40H34N2O12/c1-45-29-13-23(14-30(46-2)37(29)49-5)39(17-41)33(35(43)21-7-9-25-27(11-21)53-19-51-25)34(36(44)22-8-10-26-28(12-22)54-20-52-26)40(39,18-42)24-15-31(47-3)38(50-6)32(16-24)48-4/h7-16,33-34H,19-20H2,1-6H3
InChIKey LJRYNXRESZYJMG-UHFFFAOYSA-N
Mol Weight 734.7 g/mol
Molecular Formula C40H34N2O12
Exact Mass 734.211175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FLATMwxuNr
Name 1,-t-2-Bis(3,4,5-Trimethoxyphenyl)-c-3,t-4-bis(3,4-methylenedioxyphenyl)-r-1,c-2-cyclobutanedinitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H34N2O12
InChI InChI=1S/C40H34N2O12/c1-45-29-13-23(14-30(46-2)37(29)49-5)39(17-41)33(35(43)21-7-9-25-27(11-21)53-19-51-25)34(36(44)22-8-10-26-28(12-22)54-20-52-26)40(39,18-42)24-15-31(47-3)38(50-6)32(16-24)48-4/h7-16,33-34H,19-20H2,1-6H3
InChIKey LJRYNXRESZYJMG-UHFFFAOYSA-N
Molecular Weight 734.714 g/mol
SMILES C1(C(c2cc(OC)c(c(c2)OC)OC)(C#N)C(C1C(c1cc2OCOc2cc1)=O)C(c1cc2OCOc2cc1)=O)(c1cc(OC)c(c(c1)OC)OC)C#N
SPLASH splash10-0002-0903000000-cc979df4c054ba76251b
Source of Spectrum F-50-9299-11
Wiley ID 1416005