thieno[2,3-b]pyridine-2-carboxylic acid, 3-amino-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-, butyl ester

SpectraBase Compound ID	AoC0oky5Bpc
InChI	InChI=1S/C18H15F3N2O3S2/c1-2-3-6-26-17(25)14-12(22)9-8-10(13(24)11-5-4-7-27-11)15(18(19,20)21)23-16(9)28-14/h4-5,7-8H,2-3,6,22H2,1H3
InChIKey	YGCREIQCMDDQFM-UHFFFAOYSA-N Google Search
Mol Weight	428.44 g/mol
Molecular Formula	C18H15F3N2O3S2
Exact Mass	428.047619 g/mol

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SpectraBase Spectrum ID	3Ak0Vd5dG9m
Name	thieno[2,3-b]pyridine-2-carboxylic acid, 3-amino-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-, butyl ester
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/C18H15F3N2O3S2/c1-2-3-6-26-17(25)14-12(22)9-8-10(13(24)11-5-4-7-27-11)15(18(19,20)21)23-16(9)28-14/h4-5,7-8H,2-3,6,22H2,1H3
InChIKey	YGCREIQCMDDQFM-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_2216
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: F14553; Labnumber: SHEL-S0837-0008