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5-(4-Amylphenyl)-2-(4-butoxyphenyl)-pyrimidine

View entire compound with spectra: 1 NMR

5-(4-Amylphenyl)-2-(4-butoxyphenyl)-pyrimidine
SpectraBase Compound ID LhJGI7JDvje
InChI InChI=1S/C25H30N2O/c1-3-5-7-8-20-9-11-21(12-10-20)23-18-26-25(27-19-23)22-13-15-24(16-14-22)28-17-6-4-2/h9-16,18-19H,3-8,17H2,1-2H3
InChIKey RZYGKNFGHYQIDX-UHFFFAOYSA-N
Mol Weight 374.53 g/mol
Molecular Formula C25H30N2O
Exact Mass 374.235814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IOTebkhz0XK
Name 5-(4-Amylphenyl)-2-(4-butoxyphenyl)-pyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 374.235813593 u
Formula C25H30N2O
InChI InChI=1S/C25H30N2O/c1-3-5-7-8-20-9-11-21(12-10-20)23-18-26-25(27-19-23)22-13-15-24(16-14-22)28-17-6-4-2/h9-16,18-19H,3-8,17H2,1-2H3
InChIKey RZYGKNFGHYQIDX-UHFFFAOYSA-N
Molecular Weight 374.528 g/mol
SMILES C1(=NC=C(C=N1)C1=CC=C(C=C1)CCCCC)C1=CC=C(C=C1)OCCCC