sodium S-{[5-(6-ethoxy-6-oxohexanoyl)-2-oxo-2,3-dihydro-1H-imidazol-4-yl]methyl} thiosulfate

SpectraBase Compound ID	5CjXARDcJbq
InChI	InChI=1S/C12H18N2O7S2.Na/c1-2-21-10(16)6-4-3-5-9(15)11-8(13-12(17)14-11)7-22-23(18,19)20;/h2-7H2,1H3,(H2,13,14,17)(H,18,19,20);/q;+1/p-1
InChIKey	ASXLIENQSKSZTL-UHFFFAOYSA-M Google Search
Mol Weight	388.38 g/mol
Molecular Formula	C12H17N2NaO7S2
Exact Mass	388.037488 g/mol

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SpectraBase Spectrum ID	5iPBAJbOuAX
Name	sodium S-{[5-(6-ethoxy-6-oxohexanoyl)-2-oxo-2,3-dihydro-1H-imidazol-4-yl]methyl} thiosulfate
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/C12H18N2O7S2.Na/c1-2-21-10(16)6-4-3-5-9(15)11-8(13-12(17)14-11)7-22-23(18,19)20;/h2-7H2,1H3,(H2,13,14,17)(H,18,19,20);/q;+1/p-1
InChIKey	ASXLIENQSKSZTL-UHFFFAOYSA-M
NMR Offset	17.1563
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_8574
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: UZI/9679442; Labnumber: DGP-nal2/0129; UZI_ID: UZI-008576
Temperature	308 °C