thiocyanic acid, alpha-[(p-tolylsulfonyl)methyl]benzyl ester

SpectraBase Compound ID	6sJWzyR45TR
InChI	InChI=1S/C16H15NO2S2/c1-13-7-9-15(10-8-13)21(18,19)11-16(20-12-17)14-5-3-2-4-6-14/h2-10,16H,11H2,1H3
InChIKey	LYGIYIJZXPJYGQ-UHFFFAOYSA-N Google Search
Mol Weight	317.42 g/mol
Molecular Formula	C16H15NO2S2
Exact Mass	317.054421 g/mol

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SpectraBase Spectrum ID	ChblYlSGH4a
Name	thiocyanic acid, 2-[(4-methylphenyl)sulfonyl]-1-phenylethyl ester
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/C16H15NO2S2/c1-13-7-9-15(10-8-13)21(18,19)11-16(20-12-17)14-5-3-2-4-6-14/h2-10,16H,11H2,1H3
InChIKey	LYGIYIJZXPJYGQ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_8255
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/11218386