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1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(pyridin-2-yl)piperazine

View entire compound with spectra: 1 NMR

1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(pyridin-2-yl)piperazine
SpectraBase Compound ID L0JSgP4e8tR
InChI InChI=1S/C21H27N7/c1-21(2,3)28-20(23-24-25-28)19(17-9-5-4-6-10-17)27-15-13-26(14-16-27)18-11-7-8-12-22-18/h4-12,19H,13-16H2,1-3H3
InChIKey KNKZYCJBFKLOOG-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C21H27N7
Exact Mass 377.232794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARbRGG6J5YH
Name 1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(pyridin-2-yl)piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.232793897 u
Formula C21H27N7
InChI InChI=1S/C21H27N7/c1-21(2,3)28-20(23-24-25-28)19(17-9-5-4-6-10-17)27-15-13-26(14-16-27)18-11-7-8-12-22-18/h4-12,19H,13-16H2,1-3H3
InChIKey KNKZYCJBFKLOOG-UHFFFAOYSA-N
Molecular Weight 377.496 g/mol
SMILES C1N(CCN(C1)C1=CC=CC=N1)C(C1=CC=CC=C1)C=1N(N=NN1)C(C)(C)C