[(o-nitrobenzyl)thio]acetic acid

SpectraBase Compound ID	4x6psPqpjub
InChI	InChI=1S/C9H9NO4S/c11-9(12)6-15-5-7-3-1-2-4-8(7)10(13)14/h1-4H,5-6H2,(H,11,12)
InChIKey	DUZOLSSGVIWWSU-UHFFFAOYSA-N Google Search
Mol Weight	227.23 g/mol
Molecular Formula	C9H9NO4S
Exact Mass	227.025229 g/mol

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SpectraBase Spectrum ID	4QmyxoXshmP
Name	[(2-nitrobenzyl)sulfanyl]acetic acid
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/C9H9NO4S/c11-9(12)6-15-5-7-3-1-2-4-8(7)10(13)14/h1-4H,5-6H2,(H,11,12)
InChIKey	DUZOLSSGVIWWSU-UHFFFAOYSA-N
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_15496
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: 987/00002116; Labnumber: 987/00002116218825; VK_ID: VK-015501
Temperature	308 °C