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1-(2'-(1-benzyl-1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)ethanone

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1-(2'-(1-benzyl-1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)ethanone
SpectraBase Compound ID 1e0jh4SrpSV
InChI InChI=1S/C22H18N4O/c1-16(27)18-11-13-19(14-12-18)20-9-5-6-10-21(20)22-23-24-25-26(22)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKey WEDNSXABRRZRCD-UHFFFAOYSA-N
Mol Weight 354.41 g/mol
Molecular Formula C22H18N4O
Exact Mass 354.148061 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ey3SwteCnYM
Name 1-{2'-(1-Benzyl-1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl}ethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.148061215 u
Formula C22H18N4O
InChI InChI=1S/C22H18N4O/c1-16(27)18-11-13-19(14-12-18)20-9-5-6-10-21(20)22-23-24-25-26(22)15-17-7-3-2-4-8-17/h2-14H,15H2,1H3
InChIKey WEDNSXABRRZRCD-UHFFFAOYSA-N
Molecular Weight 354.413 g/mol
SMILES C=1(N(N=NN1)CC1=CC=CC=C1)C1=C(C2=CC=C(C=C2)C(=O)C)C=CC=C1