dibenzo[c,f][1,2,5]thiadiazepine, 6,11-dihydro-3-nitro-, 5,5-dioxide

SpectraBase Compound ID	CofNckzEJK0
InChI	InChI=1S/C12H9N3O4S/c16-15(17)8-5-6-11-12(7-8)20(18,19)14-10-4-2-1-3-9(10)13-11/h1-7,13-14H
InChIKey	JTOLKEUVIXXRNQ-UHFFFAOYSA-N Google Search
Mol Weight	291.28 g/mol
Molecular Formula	C12H9N3O4S
Exact Mass	291.031377 g/mol

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SpectraBase Spectrum ID	DshQGytjEg
Name	dibenzo[c,f][1,2,5]thiadiazepine, 6,11-dihydro-3-nitro-, 5,5-dioxide
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/C12H9N3O4S/c16-15(17)8-5-6-11-12(7-8)20(18,19)14-10-4-2-1-3-9(10)13-11/h1-7,13-14H
InChIKey	JTOLKEUVIXXRNQ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_7329
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/18307133; Labnumber: SP-X001380