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1H-1,2,3-triazole-4-carboxamide, 5-amino-1-(3-bromophenyl)-N-(2-phenylethyl)-

View entire compound with spectra: 2 NMR

1H-1,2,3-triazole-4-carboxamide, 5-amino-1-(3-bromophenyl)-N-(2-phenylethyl)-
SpectraBase Compound ID 7EjmWbQtgSS
InChI InChI=1S/C17H16BrN5O/c18-13-7-4-8-14(11-13)23-16(19)15(21-22-23)17(24)20-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10,19H2,(H,20,24)
InChIKey NKXYWRFCQQRRHQ-UHFFFAOYSA-N
Mol Weight 386.25 g/mol
Molecular Formula C17H16BrN5O
Exact Mass 385.053823 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GL01lVjq2Dh
Name 1H-1,2,3-Triazole-4-carboxamide, 5-amino-1-(3-bromophenyl)-N-(2-phenylethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.053823154 u
Formula C17H16BrN5O
InChI InChI=1S/C17H16BrN5O/c18-13-7-4-8-14(11-13)23-16(19)15(21-22-23)17(24)20-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10,19H2,(H,20,24)
InChIKey NKXYWRFCQQRRHQ-UHFFFAOYSA-N
Molecular Weight 386.253 g/mol
SMILES N(C(C=1N=NN(C1N)C1=CC(Br)=CC=C1)=O)CCC1=CC=CC=C1