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N-(2-ethoxyphenyl)-N-[(1E)-3,4,4-trichloro-2-nitro-1-(1H-1,2,4-triazol-1-yl)-1,3-butadienyl]amine
SpectraBase Compound ID Fq3utJ38b6B
InChI InChI=1S/C14H12Cl3N5O3/c1-2-25-10-6-4-3-5-9(10)20-14(21-8-18-7-19-21)12(22(23)24)11(15)13(16)17/h3-8,20H,2H2,1H3/b14-12+
InChIKey ONMKSIHVAQJEND-WYMLVPIESA-N
Mol Weight 404.64 g/mol
Molecular Formula C14H12Cl3N5O3
Exact Mass 403.000572 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 95uhVChlbMj
Name N-(2-ethoxyphenyl)-N-[(1E)-3,4,4-trichloro-2-nitro-1-(1H-1,2,4-triazol-1-yl)-1,3-butadienyl]amine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.000572363 u
Formula C14H12Cl3N5O3
InChI InChI=1S/C14H12Cl3N5O3/c1-2-25-10-6-4-3-5-9(10)20-14(21-8-18-7-19-21)12(22(23)24)11(15)13(16)17/h3-8,20H,2H2,1H3/b14-12+
InChIKey ONMKSIHVAQJEND-WYMLVPIESA-N
Molecular Weight 404.641 g/mol
NMR Offset 17.9891
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4189
Solvent DMSO-d6
Source Vendor ID: NMR/12308848