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ethyl 1-(4-(4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate

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ethyl 1-(4-(4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
SpectraBase Compound ID 7y2o0ab1siY
InChI InChI=1S/C19H18N8O5/c1-4-30-18(28)13-11(3)26(24-20-13)16-17(23-32-22-16)27-15(12-9-7-6-8-10-12)14(21-25-27)19(29)31-5-2/h6-10H,4-5H2,1-3H3
InChIKey DLNSFKXINRCVSL-UHFFFAOYSA-N
Mol Weight 438.4 g/mol
Molecular Formula C19H18N8O5
Exact Mass 438.140016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7pA9PELW09Y
Name Ethyl 1-(4-(4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl)-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.140015707 u
Formula C19H18N8O5
InChI InChI=1S/C19H18N8O5/c1-4-30-18(28)13-11(3)26(24-20-13)16-17(23-32-22-16)27-15(12-9-7-6-8-10-12)14(21-25-27)19(29)31-5-2/h6-10H,4-5H2,1-3H3
InChIKey DLNSFKXINRCVSL-UHFFFAOYSA-N
Molecular Weight 438.404 g/mol
SMILES C=1C=CC(C=2N(C=3C(N4N=NC(=C4C)C(=O)OCC)=NON3)N=NC2C(=O)OCC)=CC1