5-{[4-(4-sec-butylphenyl)-3-(ethoxycarbonyl)-5-methyl-2-thienyl]amino}-5-oxopentanoic acid

SpectraBase Compound ID	7Q6LpHGwIqr
InChI	InChI=1S/C23H29NO5S/c1-5-14(3)16-10-12-17(13-11-16)20-15(4)30-22(21(20)23(28)29-6-2)24-18(25)8-7-9-19(26)27/h10-14H,5-9H2,1-4H3,(H,24,25)(H,26,27)
InChIKey	IOULTOQIAVQLKQ-UHFFFAOYSA-N Google Search
Mol Weight	431.55 g/mol
Molecular Formula	C23H29NO5S
Exact Mass	431.176644 g/mol

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SpectraBase Spectrum ID	EcrY9yqeYiU
Name	5-{[4-(4-sec-butylphenyl)-3-(ethoxycarbonyl)-5-methyl-2-thienyl]amino}-5-oxopentanoic acid
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/C23H29NO5S/c1-5-14(3)16-10-12-17(13-11-16)20-15(4)30-22(21(20)23(28)29-6-2)24-18(25)8-7-9-19(26)27/h10-14H,5-9H2,1-4H3,(H,24,25)(H,26,27)
InChIKey	IOULTOQIAVQLKQ-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_20511
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/9142421; Labnumber: U_AM_ACK/047232; UZI_ID: UZI-020519
Temperature	318 °C