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1H-1,2,3-triazole-4,5-dicarboxylic acid, 1-[2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl]-, diethyl ester
SpectraBase Compound ID EVYYG41d7Jh
InChI InChI=1S/C18H20N4O7/c1-3-26-17(24)15-16(18(25)27-4-2)22(21-20-15)10-14(23)19-11-5-6-12-13(9-11)29-8-7-28-12/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,23)
InChIKey HWSKPMDFUUNXFW-UHFFFAOYSA-N
Mol Weight 404.38 g/mol
Molecular Formula C18H20N4O7
Exact Mass 404.133199 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3nKOIz0tGb3
Name 1H-1,2,3-triazole-4,5-dicarboxylic acid, 1-[2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl]-, diethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.133198993 u
Formula C18H20N4O7
InChI InChI=1S/C18H20N4O7/c1-3-26-17(24)15-16(18(25)27-4-2)22(21-20-15)10-14(23)19-11-5-6-12-13(9-11)29-8-7-28-12/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,19,23)
InChIKey HWSKPMDFUUNXFW-UHFFFAOYSA-N
Molecular Weight 404.379 g/mol
NMR Offset 17.9973
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8085
Solvent DMSO-d6
Source Vendor ID: NMR/13309076