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ethyl 3-[3,5-bis(2-methylphenyl)-1H-pyrazol-1-yl]propanoate

View entire compound with spectra: 2 NMR

ethyl 3-[3,5-bis(2-methylphenyl)-1H-pyrazol-1-yl]propanoate
SpectraBase Compound ID K9NQikjeKBu
InChI InChI=1S/C22H24N2O2/c1-4-26-22(25)13-14-24-21(19-12-8-6-10-17(19)3)15-20(23-24)18-11-7-5-9-16(18)2/h5-12,15H,4,13-14H2,1-3H3
InChIKey FJXYMGZXLFNREL-UHFFFAOYSA-N
Mol Weight 348.45 g/mol
Molecular Formula C22H24N2O2
Exact Mass 348.183778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtWR8LihgVf
Name Ethyl 3-[3,5-bis(2-methylphenyl)-1H-pyrazol-1-yl]propanoate
Comments Computed using HOSE algorithm
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Exact Mass 348.183778019 u
Formula C22H24N2O2
InChI InChI=1S/C22H24N2O2/c1-4-26-22(25)13-14-24-21(19-12-8-6-10-17(19)3)15-20(23-24)18-11-7-5-9-16(18)2/h5-12,15H,4,13-14H2,1-3H3
InChIKey FJXYMGZXLFNREL-UHFFFAOYSA-N
Molecular Weight 348.446 g/mol
SMILES CCOC(CCN1C(=CC(=N1)C=1C(C)=CC=CC1)C=1C(C)=CC=CC1)=O