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4-(1,3-benzoxazol-2-ylsulfanyl)-3-nitrobenzonitrile

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4-(1,3-benzoxazol-2-ylsulfanyl)-3-nitrobenzonitrile
SpectraBase Compound ID 5kavICEKDRZ
InChI InChI=1S/C14H7N3O3S/c15-8-9-5-6-13(11(7-9)17(18)19)21-14-16-10-3-1-2-4-12(10)20-14/h1-7H
InChIKey AAMBIVWDDAAYHM-UHFFFAOYSA-N
Mol Weight 297.29 g/mol
Molecular Formula C14H7N3O3S
Exact Mass 297.020812 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Krch7l4l5m
Name 4-(1,3-benzoxazol-2-ylsulfanyl)-3-nitrobenzonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H7N3O3S/c15-8-9-5-6-13(11(7-9)17(18)19)21-14-16-10-3-1-2-4-12(10)20-14/h1-7H
InChIKey AAMBIVWDDAAYHM-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_1685
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/8325606; Labnumber: AIS-0000245; IOH_ID: IOH-001686
Temperature 297 °C