propanoic acid, 3-[(3-butyl-8-methoxy-2-methyl-4-quinolinyl)thio]-

SpectraBase Compound ID	7V4Y9RNW4eg
InChI	InChI=1S/C18H23NO3S/c1-4-5-7-13-12(2)19-17-14(8-6-9-15(17)22-3)18(13)23-11-10-16(20)21/h6,8-9H,4-5,7,10-11H2,1-3H3,(H,20,21)
InChIKey	GPKRRCPYXLBTHM-UHFFFAOYSA-N Google Search
Mol Weight	333.45 g/mol
Molecular Formula	C18H23NO3S
Exact Mass	333.139865 g/mol

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SpectraBase Spectrum ID	CP2HS8By4eU
Name	propanoic acid, 3-[(3-butyl-8-methoxy-2-methyl-4-quinolinyl)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	333.139864776 u
Formula	C18H23NO3S
InChI	InChI=1S/C18H23NO3S/c1-4-5-7-13-12(2)19-17-14(8-6-9-15(17)22-3)18(13)23-11-10-16(20)21/h6,8-9H,4-5,7,10-11H2,1-3H3,(H,20,21)
InChIKey	GPKRRCPYXLBTHM-UHFFFAOYSA-N
Molecular Weight	333.446 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_15644
Solvent	DMSO-d6
Source	Vendor ID: ZI/10037264; Lab Info: DUR; Lab Number: DUR-AD00750