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acetic acid, [(4,8-dimethyl-2-quinolinyl)thio]-
SpectraBase Compound ID F83ZrRZmz7F
InChI InChI=1S/C13H13NO2S/c1-8-4-3-5-10-9(2)6-11(14-13(8)10)17-7-12(15)16/h3-6H,7H2,1-2H3,(H,15,16)
InChIKey CJPQHSHSXLRYFT-UHFFFAOYSA-N
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 33DoCodFgC
Name acetic acid, [(4,8-dimethyl-2-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 247.066699835 u
Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-8-4-3-5-10-9(2)6-11(14-13(8)10)17-7-12(15)16/h3-6H,7H2,1-2H3,(H,15,16)
InChIKey CJPQHSHSXLRYFT-UHFFFAOYSA-N
Molecular Weight 247.312 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15642
Solvent DMSO-d6
Source Vendor ID: ZI/10036675; Lab Info: DUR; Lab Number: DUR-AD00724