propanamide, 3-[(2-chloro-9H-purin-6-yl)thio]-N-(3-methylbutyl)-

SpectraBase Compound ID	NcbWqSEKJu
InChI	InChI=1S/C13H18ClN5OS/c1-8(2)3-5-15-9(20)4-6-21-12-10-11(17-7-16-10)18-13(14)19-12/h7-8H,3-6H2,1-2H3,(H,15,20)(H,16,17,18,19)
InChIKey	CDPWFZSPQZSSCM-UHFFFAOYSA-N Google Search
Mol Weight	327.83 g/mol
Molecular Formula	C13H18ClN5OS
Exact Mass	327.092059 g/mol

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SpectraBase Spectrum ID	5CqkIfm8UtK
Name	propanamide, 3-[(2-chloro-9H-purin-6-yl)thio]-N-(3-methylbutyl)-
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/C13H18ClN5OS/c1-8(2)3-5-15-9(20)4-6-21-12-10-11(17-7-16-10)18-13(14)19-12/h7-8H,3-6H2,1-2H3,(H,15,20)(H,16,17,18,19)
InChIKey	CDPWFZSPQZSSCM-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_6117
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: F27152; Labnumber: ExLab-203398