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diethyl 1-[2-(3-chloroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
SpectraBase Compound ID KI8Jj8oIGmt
InChI InChI=1S/C16H17ClN4O5/c1-3-25-15(23)13-14(16(24)26-4-2)21(20-19-13)9-12(22)18-11-7-5-6-10(17)8-11/h5-8H,3-4,9H2,1-2H3,(H,18,22)
InChIKey SBUSRBXZOZPGSH-UHFFFAOYSA-N
Mol Weight 380.79 g/mol
Molecular Formula C16H17ClN4O5
Exact Mass 380.088747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID WoRZzNnufS
Name diethyl 1-[2-(3-chloroanilino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.088747358 u
Formula C16H17ClN4O5
InChI InChI=1S/C16H17ClN4O5/c1-3-25-15(23)13-14(16(24)26-4-2)21(20-19-13)9-12(22)18-11-7-5-6-10(17)8-11/h5-8H,3-4,9H2,1-2H3,(H,18,22)
InChIKey SBUSRBXZOZPGSH-UHFFFAOYSA-N
Molecular Weight 380.788 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7685
Solvent DMSO-d6
Source Vendor ID: NMR/13218351