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1-[1-(1-azepanyl)-3,4,4-trichloro-2-nitro-1,3-butadienyl]azepane
SpectraBase Compound ID 2J0vgLw4N6k
InChI InChI=1S/C16H24Cl3N3O2/c17-13(15(18)19)14(22(23)24)16(20-9-5-1-2-6-10-20)21-11-7-3-4-8-12-21/h1-12H2
InChIKey RFWFTUHMWWNOKI-UHFFFAOYSA-N
Mol Weight 396.75 g/mol
Molecular Formula C16H24Cl3N3O2
Exact Mass 395.09341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6LyO3UNEAkV
Name 1-[1-(1-azepanyl)-3,4,4-trichloro-2-nitro-1,3-butadienyl]azepane
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.093410123 u
Formula C16H24Cl3N3O2
InChI InChI=1S/C16H24Cl3N3O2/c17-13(15(18)19)14(22(23)24)16(20-9-5-1-2-6-10-20)21-11-7-3-4-8-12-21/h1-12H2
InChIKey RFWFTUHMWWNOKI-UHFFFAOYSA-N
Molecular Weight 396.746 g/mol
NMR Offset 17.9881
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4205
Solvent CDCl3
Source Vendor ID: NMR/12308867