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N-[(1E)-1-(1H-1,2,3-benzotriazol-1-yl)-3,4,4-trichloro-2-nitro-1,3-butadienyl]-4-chloroaniline
SpectraBase Compound ID FT0lar5naNk
InChI InChI=1S/C16H9Cl4N5O2/c17-9-5-7-10(8-6-9)21-16(14(25(26)27)13(18)15(19)20)24-12-4-2-1-3-11(12)22-23-24/h1-8,21H/b16-14+
InChIKey BYYRECCGAUIATI-JQIJEIRASA-N
Mol Weight 445.1 g/mol
Molecular Formula C16H9Cl4N5O2
Exact Mass 442.951035 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AWwdm5I5PqY
Name N-[(1E)-1-(1H-1,2,3-benzotriazol-1-yl)-3,4,4-trichloro-2-nitro-1,3-butadienyl]-4-chloroaniline
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.951035348 u
Formula C16H9Cl4N5O2
InChI InChI=1S/C16H9Cl4N5O2/c17-9-5-7-10(8-6-9)21-16(14(25(26)27)13(18)15(19)20)24-12-4-2-1-3-11(12)22-23-24/h1-8,21H/b16-14+
InChIKey BYYRECCGAUIATI-JQIJEIRASA-N
Molecular Weight 445.093 g/mol
NMR Offset 17.989
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4196
Solvent CDCl3
Source Vendor ID: NMR/12308856