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

View entire compound with spectra: 1 NMR

1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(4-methoxyphenyl)piperazine
SpectraBase Compound ID 26FCvxUyN3H
InChI InChI=1S/C23H30N6O/c1-23(2,3)29-22(24-25-26-29)21(18-8-6-5-7-9-18)28-16-14-27(15-17-28)19-10-12-20(30-4)13-11-19/h5-13,21H,14-17H2,1-4H3
InChIKey RWTMIMOBLIBHLD-UHFFFAOYSA-N
Mol Weight 406.53 g/mol
Molecular Formula C23H30N6O
Exact Mass 406.24811 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKqS0sDPqZO
Name 1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(4-methoxyphenyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 406.248109609 u
Formula C23H30N6O
InChI InChI=1S/C23H30N6O/c1-23(2,3)29-22(24-25-26-29)21(18-8-6-5-7-9-18)28-16-14-27(15-17-28)19-10-12-20(30-4)13-11-19/h5-13,21H,14-17H2,1-4H3
InChIKey RWTMIMOBLIBHLD-UHFFFAOYSA-N
Molecular Weight 406.534 g/mol
SMILES C1N(CCN(C1)C1=CC=C(C=C1)OC)C(C1=CC=CC=C1)C=1N(N=NN1)C(C)(C)C