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1-((1-Butyl-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2-methoxyphenyl)piperazine

View entire compound with spectra: 1 NMR

1-((1-Butyl-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2-methoxyphenyl)piperazine
SpectraBase Compound ID JYn8rihGzuk
InChI InChI=1S/C23H30N6O/c1-3-4-14-29-23(24-25-26-29)22(19-10-6-5-7-11-19)28-17-15-27(16-18-28)20-12-8-9-13-21(20)30-2/h5-13,22H,3-4,14-18H2,1-2H3
InChIKey PSFLCYMIIMPACF-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 7WFM0dRTacQ
Name 1-((1-Butyl-1H-tetrazol-5-yl)(phenyl)methyl)-4-(2-methoxyphenyl)piperazine
Comments Computed using HOSE algorithm
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Exact Mass 406.248109609 u
Formula C23H30N6O
InChI InChI=1S/C23H30N6O/c1-3-4-14-29-23(24-25-26-29)22(19-10-6-5-7-11-19)28-17-15-27(16-18-28)20-12-8-9-13-21(20)30-2/h5-13,22H,3-4,14-18H2,1-2H3
InChIKey PSFLCYMIIMPACF-UHFFFAOYSA-N
Molecular Weight 406.534 g/mol
SMILES C1N(CCN(C1)C1=C(C=CC=C1)OC)C(C1=CC=CC=C1)C=1N(N=NN1)CCCC