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2-(1,3-Benzodioxol-5-yl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole

View entire compound with spectra: 2 NMR

2-(1,3-Benzodioxol-5-yl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole
SpectraBase Compound ID LH9vBahgcSE
InChI InChI=1S/C19H18N2O3/c1-19(2,3)14-7-4-12(5-8-14)17-20-21-18(24-17)13-6-9-15-16(10-13)23-11-22-15/h4-10H,11H2,1-3H3
InChIKey WJQXKWDUXINATL-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C19H18N2O3
Exact Mass 322.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1fwFXrQ7dA8
Name 2-(1,3-Benzodioxol-5-yl)-5-(4-tert-butylphenyl)-1,3,4-oxadiazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.131742445 u
Formula C19H18N2O3
InChI InChI=1S/C19H18N2O3/c1-19(2,3)14-7-4-12(5-8-14)17-20-21-18(24-17)13-6-9-15-16(10-13)23-11-22-15/h4-10H,11H2,1-3H3
InChIKey WJQXKWDUXINATL-UHFFFAOYSA-N
Molecular Weight 322.364 g/mol
SMILES CC(C1=CC=C(C2=NN=C(O2)C2=CC=3OCOC3C=C2)C=C1)(C)C