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1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2,5-dimethylphenyl)piperazine
SpectraBase Compound ID A9pI7JIJhwI
InChI InChI=1S/C24H32N6/c1-18-11-12-19(2)21(17-18)28-13-15-29(16-14-28)22(20-9-7-6-8-10-20)23-25-26-27-30(23)24(3,4)5/h6-12,17,22H,13-16H2,1-5H3
InChIKey AWOXFSIUXJDOAZ-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C24H32N6
Exact Mass 404.268845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iig6ni1ZTqu
Name 1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2,5-dimethylphenyl)piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.268845054 u
Formula C24H32N6
InChI InChI=1S/C24H32N6/c1-18-11-12-19(2)21(17-18)28-13-15-29(16-14-28)22(20-9-7-6-8-10-20)23-25-26-27-30(23)24(3,4)5/h6-12,17,22H,13-16H2,1-5H3
InChIKey AWOXFSIUXJDOAZ-UHFFFAOYSA-N
Molecular Weight 404.562 g/mol
SMILES C1N(CCN(C1)C1=C(C=CC(=C1)C)C)C(C1=CC=CC=C1)C=1N(N=NN1)C(C)(C)C