2-[6-Amino-9-(2-p-tolyloxy-ethyl)-9H-purin-8-ylsulfanyl]-ethanol

SpectraBase Compound ID	4SAS26vtbGu
InChI	InChI=1S/C16H19N5O2S/c1-11-2-4-12(5-3-11)23-8-6-21-15-13(14(17)18-10-19-15)20-16(21)24-9-7-22/h2-5,10,22H,6-9H2,1H3,(H2,17,18,19)
InChIKey	AQVVJHLDXNHTJW-UHFFFAOYSA-N Google Search
Mol Weight	345.42 g/mol
Molecular Formula	C16H19N5O2S
Exact Mass	345.125946 g/mol

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SpectraBase Spectrum ID	If14bf4P6yb
Name	ethanol, 2-[[6-amino-9-[2-(4-methylphenoxy)ethyl]-9H-purin-8-yl]thio]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	345.125946044 u
Formula	C16H19N5O2S
InChI	InChI=1S/C16H19N5O2S/c1-11-2-4-12(5-3-11)23-8-6-21-15-13(14(17)18-10-19-15)20-16(21)24-9-7-22/h2-5,10,22H,6-9H2,1H3,(H2,17,18,19)
InChIKey	AQVVJHLDXNHTJW-UHFFFAOYSA-N
Molecular Weight	345.421 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_15858
Solvent	DMSO-d6
Source	Vendor ID: NMR/11221063; Lab Info: JSA; Lab Number: JSA-0000335