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3,3'-(Hexamethylenebis(oxy-p-phenylene))dipropionitrile
SpectraBase Compound ID E28RwVjF5hi
InChI InChI=1S/C24H28N2O2/c25-17-5-7-21-9-13-23(14-10-21)27-19-3-1-2-4-20-28-24-15-11-22(12-16-24)8-6-18-26/h9-16H,1-8,19-20H2
InChIKey OMVRYRZNCVMECF-UHFFFAOYSA-N
Mol Weight 376.5 g/mol
Molecular Formula C24H28N2O2
Exact Mass 376.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 88YrgsxvVVC
Name 3,3'-(Hexamethylenebis(oxy-p-phenylene))dipropionitrile
Comments Computed using HOSE algorithm
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Exact Mass 376.215078148 u
Formula C24H28N2O2
InChI InChI=1S/C24H28N2O2/c25-17-5-7-21-9-13-23(14-10-21)27-19-3-1-2-4-20-28-24-15-11-22(12-16-24)8-6-18-26/h9-16H,1-8,19-20H2
InChIKey OMVRYRZNCVMECF-UHFFFAOYSA-N
Molecular Weight 376.500 g/mol
SMILES C1=C(C=CC(=C1)CCC#N)OCCCCCCOC1=CC=C(C=C1)CCC#N