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1-(5-nitro-3-oxido-2-phenyl-2H-1,2,3-triazol-4-yl)azepane

View entire compound with spectra: 1 NMR

1-(5-nitro-3-oxido-2-phenyl-2H-1,2,3-triazol-4-yl)azepane
SpectraBase Compound ID 3hYI237cSCW
InChI InChI=1S/C14H17N5O3/c20-18-14(16-10-6-1-2-7-11-16)13(19(21)22)15-17(18)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2
InChIKey DKOQWLZWNFTSNX-UHFFFAOYSA-N
Mol Weight 303.32 g/mol
Molecular Formula C14H17N5O3
Exact Mass 303.133139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4sf5bm5H4yc
Name 1-(5-nitro-3-oxido-2-phenyl-2H-1,2,3-triazol-4-yl)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 303.133139424 u
Formula C14H17N5O3
InChI InChI=1S/C14H17N5O3/c20-18-14(16-10-6-1-2-7-11-16)13(19(21)22)15-17(18)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2
InChIKey DKOQWLZWNFTSNX-UHFFFAOYSA-N
Molecular Weight 303.322 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5119
Solvent DMSO-d6
Source Vendor ID: NMR/12318377