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1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2,3-dimethylphenyl)piperazine

View entire compound with spectra: 1 NMR

1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2,3-dimethylphenyl)piperazine
SpectraBase Compound ID EpY3piRoEP4
InChI InChI=1S/C24H32N6/c1-18-10-9-13-21(19(18)2)28-14-16-29(17-15-28)22(20-11-7-6-8-12-20)23-25-26-27-30(23)24(3,4)5/h6-13,22H,14-17H2,1-5H3
InChIKey FBIJPBLKGNNQOP-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 3vsOdjnoS90
Name 1-((1-(Tert-butyl)-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2,3-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/c1-18-10-9-13-21(19(18)2)28-14-16-29(17-15-28)22(20-11-7-6-8-12-20)23-25-26-27-30(23)24(3,4)5/h6-13,22H,14-17H2,1-5H3
InChIKey FBIJPBLKGNNQOP-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