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1-(Benzofuran-2-yl)-N,N-dibenzyl-1-(1-butyl-1H-tetrazol-5-yl)methanamine

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1-(Benzofuran-2-yl)-N,N-dibenzyl-1-(1-butyl-1H-tetrazol-5-yl)methanamine
SpectraBase Compound ID 7y9tMYLfZtY
InChI InChI=1S/C28H29N5O/c1-2-3-18-33-28(29-30-31-33)27(26-19-24-16-10-11-17-25(24)34-26)32(20-22-12-6-4-7-13-22)21-23-14-8-5-9-15-23/h4-17,19,27H,2-3,18,20-21H2,1H3
InChIKey OHUYAUHMNMZSKR-UHFFFAOYSA-N
Mol Weight 451.57 g/mol
Molecular Formula C28H29N5O
Exact Mass 451.237211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4nBdtDvW1pM
Name 1-(Benzofuran-2-yl)-N,N-dibenzyl-1-(1-butyl-1H-tetrazol-5-yl)methanamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.237210573 u
Formula C28H29N5O
InChI InChI=1S/C28H29N5O/c1-2-3-18-33-28(29-30-31-33)27(26-19-24-16-10-11-17-25(24)34-26)32(20-22-12-6-4-7-13-22)21-23-14-8-5-9-15-23/h4-17,19,27H,2-3,18,20-21H2,1H3
InChIKey OHUYAUHMNMZSKR-UHFFFAOYSA-N
Molecular Weight 451.574 g/mol
SMILES C(N(CC1=CC=CC=C1)CC1=CC=CC=C1)(C=1N(N=NN1)CCCC)C=1OC2=CC=CC=C2C1