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4H-3,1-benzoxathiin-4-one, 2-(4-nitrophenyl)-
SpectraBase Compound ID 15jozcFJsNg
InChI InChI=1S/C14H9NO4S/c16-13-11-3-1-2-4-12(11)20-14(19-13)9-5-7-10(8-6-9)15(17)18/h1-8,14H
InChIKey JGPYSTGKMNQEJQ-UHFFFAOYSA-N
Mol Weight 287.29 g/mol
Molecular Formula C14H9NO4S
Exact Mass 287.025229 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HHrJBZU5hQ4
Name 4H-3,1-benzoxathiin-4-one, 2-(4-nitrophenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.025228944 u
Formula C14H9NO4S
InChI InChI=1S/C14H9NO4S/c16-13-11-3-1-2-4-12(11)20-14(19-13)9-5-7-10(8-6-9)15(17)18/h1-8,14H
InChIKey JGPYSTGKMNQEJQ-UHFFFAOYSA-N
Molecular Weight 287.289 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6335
Solvent DMSO-d6
Source Vendor ID: NMR/9243108; Lab Info: LP; Lab Number: LP-2190549