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5-Chloro-3-[(2-chloro-1-oxoethyl)amino]-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester
SpectraBase Compound ID Bx4rjxfRdKU
InChI InChI=1S/C14H14Cl2N2O3S/c1-4-21-14(20)12-11(18-8(19)5-15)9-6(2)10(16)7(3)17-13(9)22-12/h4-5H2,1-3H3,(H,18,19)
InChIKey MCPPUXJBIOEGPS-UHFFFAOYSA-N
Mol Weight 361.24 g/mol
Molecular Formula C14H14Cl2N2O3S
Exact Mass 360.010219 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DLvi8jPiq5b
Name thieno[2,3-b]pyridine-2-carboxylic acid, 5-chloro-3-[(chloroacetyl)amino]-4,6-dimethyl-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.010218890 u
Formula C14H14Cl2N2O3S
InChI InChI=1S/C14H14Cl2N2O3S/c1-4-21-14(20)12-11(18-8(19)5-15)9-6(2)10(16)7(3)17-13(9)22-12/h4-5H2,1-3H3,(H,18,19)
InChIKey MCPPUXJBIOEGPS-UHFFFAOYSA-N
Molecular Weight 361.243 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14893
Solvent DMSO-d6
Source Vendor ID: NMR/11210531; Lab Info: KE; Lab Number: KE-0103043