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Acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-(5-phenyltetrazol-2-yl)-
SpectraBase Compound ID 939lRPSN394
InChI InChI=1S/C16H12ClF2N5O2/c17-16(18,19)26-13-8-6-12(7-9-13)20-14(25)10-24-22-15(21-23-24)11-4-2-1-3-5-11/h1-9H,10H2,(H,20,25)
InChIKey YFVNQLHFGRULIH-UHFFFAOYSA-N
Mol Weight 379.75 g/mol
Molecular Formula C16H12ClF2N5O2
Exact Mass 379.064759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8dVATImIwQE
Name Acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-(5-phenyltetrazol-2-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.064758670 u
Formula C16H12ClF2N5O2
InChI InChI=1S/C16H12ClF2N5O2/c17-16(18,19)26-13-8-6-12(7-9-13)20-14(25)10-24-22-15(21-23-24)11-4-2-1-3-5-11/h1-9H,10H2,(H,20,25)
InChIKey YFVNQLHFGRULIH-UHFFFAOYSA-N
Molecular Weight 379.755 g/mol
SMILES C1=CC=C(C=2N=NN(N2)CC(NC2=CC=C(OC(F)(Cl)F)C=C2)=O)C=C1