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3-nitro-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)benzonitrile
SpectraBase Compound ID Fr6HQrS8PtV
InChI InChI=1S/C14H7N5O3/c15-8-9-5-6-12(13(7-9)19(21)22)18-14(20)10-3-1-2-4-11(10)16-17-18/h1-7H
InChIKey DOWAVNWYZRCAGS-UHFFFAOYSA-N
Mol Weight 293.24 g/mol
Molecular Formula C14H7N5O3
Exact Mass 293.054889 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7YMoo2AHvGm
Name benzonitrile, 3-nitro-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.054889102 u
Formula C14H7N5O3
InChI InChI=1S/C14H7N5O3/c15-8-9-5-6-12(13(7-9)19(21)22)18-14(20)10-3-1-2-4-11(10)16-17-18/h1-7H
InChIKey DOWAVNWYZRCAGS-UHFFFAOYSA-N
Molecular Weight 293.242 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4224
Solvent DMSO-d6
Source Vendor ID: NMR/9254400; Lab Info: AI; Lab Number: AI-S000703
Temperature 29.85 °C