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Cardo copolyimide B-10-¹³c

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Cardo copolyimide B-10-¹³c
SpectraBase Compound ID 2nBi3CB7ghm
InChI InChI=1S/C53H50N2O4/c1-3-4-5-6-7-8-9-10-11-12-17-34-54-49(56)41-30-32-43-48-44(33-31-42(47(41)48)50(54)57)52(59)55(51(43)58)38-28-26-37(27-29-38)53(36-24-22-35(2)23-25-36)45-20-15-13-18-39(45)40-19-14-16-21-46(40)53/h13-16,18-33H,3-12,17,34H2,1-2H3
InChIKey ZBIJODUHANIRHO-UHFFFAOYSA-N
Mol Weight 779.0 g/mol
Molecular Formula C53H50N2O4
Exact Mass 778.377058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ESWWHs7ptIG
Name Cardo copolyimide B-10-¹³c
Comments Computed using HOSE algorithm
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Exact Mass 778.377058094 u
Formula C53H50N2O4
InChI InChI=1S/C53H50N2O4/c1-3-4-5-6-7-8-9-10-11-12-17-34-54-49(56)41-30-32-43-48-44(33-31-42(47(41)48)50(54)57)52(59)55(51(43)58)38-28-26-37(27-29-38)53(36-24-22-35(2)23-25-36)45-20-15-13-18-39(45)40-19-14-16-21-46(40)53/h13-16,18-33H,3-12,17,34H2,1-2H3
InChIKey ZBIJODUHANIRHO-UHFFFAOYSA-N
Molecular Weight 778.993 g/mol
Nominal Mass 778 u
SMILES C(N1C(C2=CC=C3C4=C2C(=CC=C4C(N(C3=O)C2=CC=C(C3(C=4C=CC=CC4C4=C3C=CC=C4)C=3C=CC(=CC3)C)C=C2)=O)C1=O)=O)CCCCCCCCCCCC