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2-(5-o-Tolyl-tetrazol-2-yl)-N-(4-trifluoromethoxy-phenyl)-acetamide

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-(5-o-Tolyl-tetrazol-2-yl)-N-(4-trifluoromethoxy-phenyl)-acetamide
SpectraBase Compound ID 7emGUdENnVx
InChI InChI=1S/C17H14F3N5O2/c1-11-4-2-3-5-14(11)16-22-24-25(23-16)10-15(26)21-12-6-8-13(9-7-12)27-17(18,19)20/h2-9H,10H2,1H3,(H,21,26)
InChIKey JHPALTPXOLHZEK-UHFFFAOYSA-N
Mol Weight 377.33 g/mol
Molecular Formula C17H14F3N5O2
Exact Mass 377.109959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EsZhjBcTL53
Name 2-(5-o-Tolyl-tetrazol-2-yl)-N-(4-trifluoromethoxy-phenyl)-acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.109959198 u
Formula C17H14F3N5O2
InChI InChI=1S/C17H14F3N5O2/c1-11-4-2-3-5-14(11)16-22-24-25(23-16)10-15(26)21-12-6-8-13(9-7-12)27-17(18,19)20/h2-9H,10H2,1H3,(H,21,26)
InChIKey JHPALTPXOLHZEK-UHFFFAOYSA-N
Molecular Weight 377.327 g/mol
SMILES C1(=NN(CC(NC=2C=CC(OC(F)(F)F)=CC2)=O)N=N1)C=1C(C)=CC=CC1