7-Phenoxy-9-(p-tolylsulfanyl)-5H-benzo[b][1,4]benzoxazepin-6-one

SpectraBase Compound ID	3lwonnINVAF
InChI	InChI=1S/C26H19NO3S/c1-17-11-13-19(14-12-17)31-20-15-23(29-18-7-3-2-4-8-18)25-24(16-20)30-22-10-6-5-9-21(22)27-26(25)28/h2-16H,1H3,(H,27,28)
InChIKey	GJMZWSNFBWNOMV-UHFFFAOYSA-N Google Search
Mol Weight	425.5 g/mol
Molecular Formula	C26H19NO3S
Exact Mass	425.108565 g/mol

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SpectraBase Spectrum ID	KcG85tC5JX2
Name	dibenzo[b,f][1,4]oxazepin-11(10H)-one, 3-[(4-methylphenyl)thio]-1-phenoxy-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	425.108564647 u
Formula	C26H19NO3S
InChI	InChI=1S/C26H19NO3S/c1-17-11-13-19(14-12-17)31-20-15-23(29-18-7-3-2-4-8-18)25-24(16-20)30-22-10-6-5-9-21(22)27-26(25)28/h2-16H,1H3,(H,27,28)
InChIKey	GJMZWSNFBWNOMV-UHFFFAOYSA-N
Molecular Weight	425.502 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_14594
Solvent	DMSO-d6
Source	Vendor ID: NMR/11210744; Lab Info: MB; Lab Number: MB-1193