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2-(benzylsulfanyl)-4,6-dinitrobenzonitrile

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2-(benzylsulfanyl)-4,6-dinitrobenzonitrile
SpectraBase Compound ID DWxWbMYGniX
InChI InChI=1S/C14H9N3O4S/c15-8-12-13(17(20)21)6-11(16(18)19)7-14(12)22-9-10-4-2-1-3-5-10/h1-7H,9H2
InChIKey OOLZGMMNMGGUNG-UHFFFAOYSA-N
Mol Weight 315.3 g/mol
Molecular Formula C14H9N3O4S
Exact Mass 315.031377 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3GBjUe52RFp
Name 2-(benzylsulfanyl)-4,6-dinitrobenzonitrile
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/C14H9N3O4S/c15-8-12-13(17(20)21)6-11(16(18)19)7-14(12)22-9-10-4-2-1-3-5-10/h1-7H,9H2
InChIKey OOLZGMMNMGGUNG-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_634
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/9211349; Labnumber: L-1200003
Temperature 303 °C