octyl 3,6-diamino-5-cyanothieno[2,3-b]pyridine-2-carboxylate

SpectraBase Compound ID	4OmxEYczLTV
InChI	InChI=1S/C17H22N4O2S/c1-2-3-4-5-6-7-8-23-17(22)14-13(19)12-9-11(10-18)15(20)21-16(12)24-14/h9H,2-8,19H2,1H3,(H2,20,21)
InChIKey	JJCVALVGDACFQK-UHFFFAOYSA-N Google Search
Mol Weight	346.45 g/mol
Molecular Formula	C17H22N4O2S
Exact Mass	346.146347 g/mol

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SpectraBase Spectrum ID	5KvIMUGb8UL
Name	octyl 3,6-diamino-5-cyanothieno[2,3-b]pyridine-2-carboxylate
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/C17H22N4O2S/c1-2-3-4-5-6-7-8-23-17(22)14-13(19)12-9-11(10-18)15(20)21-16(12)24-14/h9H,2-8,19H2,1H3,(H2,20,21)
InChIKey	JJCVALVGDACFQK-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_942
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/1007675; UBI_ID: UBI-000943
Temperature	308 °C