alanine, N-[(4-methylphenyl)sulfonyl]-

SpectraBase Compound ID	BYzHueXchI2
InChI	InChI=1S/C10H13NO4S/c1-7-3-5-9(6-4-7)16(14,15)11-8(2)10(12)13/h3-6,8,11H,1-2H3,(H,12,13)
InChIKey	LQXKHFZRJYXXFA-UHFFFAOYSA-N Google Search
Mol Weight	243.28 g/mol
Molecular Formula	C10H13NO4S
Exact Mass	243.056529 g/mol

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SpectraBase Spectrum ID	CecHS9EnViR
Name	alanine, N-[(4-methylphenyl)sulfonyl]-
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/C10H13NO4S/c1-7-3-5-9(6-4-7)16(14,15)11-8(2)10(12)13/h3-6,8,11H,1-2H3,(H,12,13)
InChIKey	LQXKHFZRJYXXFA-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_8502
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/12258873