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1,1-Bis(1H-benzotriazol-1-yl)-3,4,4-trichloro-2-nitrobuta-1,3-diene

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1,1-Bis(1H-benzotriazol-1-yl)-3,4,4-trichloro-2-nitrobuta-1,3-diene
SpectraBase Compound ID LUCYxIfln89
InChI InChI=1S/C16H8Cl3N7O2/c17-13(15(18)19)14(26(27)28)16(24-11-7-3-1-5-9(11)20-22-24)25-12-8-4-2-6-10(12)21-23-25/h1-8H
InChIKey IJMIRMDQNPQEDL-UHFFFAOYSA-N
Mol Weight 436.65 g/mol
Molecular Formula C16H8Cl3N7O2
Exact Mass 434.980506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CRSidZOxxUZ
Name 1-[1-(1H-1,2,3-benzotriazol-1-yl)-3,4,4-trichloro-2-nitro-1,3-butadienyl]-1H-1,2,3-benzotriazole
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.980505624 u
Formula C16H8Cl3N7O2
InChI InChI=1S/C16H8Cl3N7O2/c17-13(15(18)19)14(26(27)28)16(24-11-7-3-1-5-9(11)20-22-24)25-12-8-4-2-6-10(12)21-23-25/h1-8H
InChIKey IJMIRMDQNPQEDL-UHFFFAOYSA-N
Molecular Weight 436.646 g/mol
NMR Offset 17.989
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4192
Solvent CDCl3
Source Vendor ID: NMR/12308851