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3,3'-(Pentamethylenebis(oxy-p-phenylene))dipropionitrile

View entire compound with spectra: 1 NMR, and 1 FTIR

3,3'-(Pentamethylenebis(oxy-p-phenylene))dipropionitrile
SpectraBase Compound ID KhmNh1TVD1M
InChI InChI=1S/C23H26N2O2/c24-16-4-6-20-8-12-22(13-9-20)26-18-2-1-3-19-27-23-14-10-21(11-15-23)7-5-17-25/h8-15H,1-7,18-19H2
InChIKey KLVNFWVCHMPPLO-UHFFFAOYSA-N
Mol Weight 362.47 g/mol
Molecular Formula C23H26N2O2
Exact Mass 362.199428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dqCnX5kdgp
Name 3,3'-(Pentamethylenebis(oxy-p-phenylene))dipropionitrile
Comments Computed using HOSE algorithm
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Exact Mass 362.199428083 u
Formula C23H26N2O2
InChI InChI=1S/C23H26N2O2/c24-16-4-6-20-8-12-22(13-9-20)26-18-2-1-3-19-27-23-14-10-21(11-15-23)7-5-17-25/h8-15H,1-7,18-19H2
InChIKey KLVNFWVCHMPPLO-UHFFFAOYSA-N
Molecular Weight 362.473 g/mol
SMILES C1=C(C=CC(=C1)CCC#N)OCCCCCOC1=CC=C(C=C1)CCC#N