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1H-1,2,3-triazole-4-carboxylic acid, 1-[4-[[[[4-[4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-yl]amino]methyl]amino]-1,2,5-
SpectraBase Compound ID BBuNaVdopLG
InChI InChI=1S/C17H20N12O6/c1-5-32-16(30)10-8(3)28(26-20-10)14-12(22-34-24-14)18-7-19-13-15(25-35-23-13)29-9(4)11(21-27-29)17(31)33-6-2/h5-7H2,1-4H3,(H,18,22)(H,19,23)
InChIKey RFMIGBYXVBNCBY-UHFFFAOYSA-N
Mol Weight 488.43 g/mol
Molecular Formula C17H20N12O6
Exact Mass 488.162876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1e0TXVkOh6H
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-[4-[[[[4-[4-(ethoxycarbonyl)-5-methyl-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-yl]amino]methyl]amino]-1,2,5-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.162876406 u
Formula C17H20N12O6
InChI InChI=1S/C17H20N12O6/c1-5-32-16(30)10-8(3)28(26-20-10)14-12(22-34-24-14)18-7-19-13-15(25-35-23-13)29-9(4)11(21-27-29)17(31)33-6-2/h5-7H2,1-4H3,(H,18,22)(H,19,23)
InChIKey RFMIGBYXVBNCBY-UHFFFAOYSA-N
Molecular Weight 488.425 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14367
Solvent DMSO-d6
Source Vendor ID: NMR/10310394; Lab Info: VUR; Lab Number: VUR-0002198