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N-(4-fluoro-2-methylphenyl)-2-(5-phenyl-2H-tetraazol-2-yl)acetamide

View entire compound with spectra: 2 NMR

N-(4-fluoro-2-methylphenyl)-2-(5-phenyl-2H-tetraazol-2-yl)acetamide
SpectraBase Compound ID meXZCaMu4n
InChI InChI=1S/C16H14FN5O/c1-11-9-13(17)7-8-14(11)18-15(23)10-22-20-16(19-21-22)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,23)
InChIKey RPSYBJQSMCYUSY-UHFFFAOYSA-N
Mol Weight 311.32 g/mol
Molecular Formula C16H14FN5O
Exact Mass 311.118238 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AD6gSTjUn42
Name N-(4-Fluoro-2-methylphenyl)-2-(5-phenyl-2H-tetraazol-2-yl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.118238253 u
Formula C16H14FN5O
InChI InChI=1S/C16H14FN5O/c1-11-9-13(17)7-8-14(11)18-15(23)10-22-20-16(19-21-22)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,23)
InChIKey RPSYBJQSMCYUSY-UHFFFAOYSA-N
Molecular Weight 311.320 g/mol
SMILES N(C(CN1N=C(N=N1)C=1C=CC=CC1)=O)C1=C(C=C(C=C1)F)C