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4-{4,5-bis[(3-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-amine

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4-{4,5-bis[(3-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-amine
SpectraBase Compound ID 1ozNIL7hVtR
InChI InChI=1S/C18H30N8O/c1-13-5-3-7-24(9-13)11-15-16(12-25-8-4-6-14(2)10-25)26(23-20-15)18-17(19)21-27-22-18/h13-14H,3-12H2,1-2H3,(H2,19,21)
InChIKey QFENPDYVIVLENT-UHFFFAOYSA-N
Mol Weight 374.49 g/mol
Molecular Formula C18H30N8O
Exact Mass 374.254258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SkrRYUGMrA
Name 4-{4,5-bis[(3-Methylpiperidin-1-yl)methyl]-1H-1,2,3-triazol-1-yl}-1,2,5-oxadiazol-3-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.254257617 u
Formula C18H30N8O
InChI InChI=1S/C18H30N8O/c1-13-5-3-7-24(9-13)11-15-16(12-25-8-4-6-14(2)10-25)26(23-20-15)18-17(19)21-27-22-18/h13-14H,3-12H2,1-2H3,(H2,19,21)
InChIKey QFENPDYVIVLENT-UHFFFAOYSA-N
Molecular Weight 374.493 g/mol
SMILES C=1(N=NN(C1CN1CCCC(C1)C)C1=NON=C1N)CN1CCCC(C1)C