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benzo[b]thiophene-3-carboxylic acid, 2-[[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester

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benzo[b]thiophene-3-carboxylic acid, 2-[[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester
SpectraBase Compound ID 5X276JSUSQ3
InChI InChI=1S/C15H16ClN3O3S/c1-19-7-9(16)12(18-19)13(20)17-14-11(15(21)22-2)8-5-3-4-6-10(8)23-14/h7H,3-6H2,1-2H3,(H,17,20)
InChIKey VXGYSHUXSLXNGW-UHFFFAOYSA-N
Mol Weight 353.82 g/mol
Molecular Formula C15H16ClN3O3S
Exact Mass 353.06009 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BEmZkzrNH5I
Name benzo[b]thiophene-3-carboxylic acid, 2-[[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, methyl 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 353.060090258 u
Formula C15H16ClN3O3S
InChI InChI=1S/C15H16ClN3O3S/c1-19-7-9(16)12(18-19)13(20)17-14-11(15(21)22-2)8-5-3-4-6-10(8)23-14/h7H,3-6H2,1-2H3,(H,17,20)
InChIKey VXGYSHUXSLXNGW-UHFFFAOYSA-N
Molecular Weight 353.824 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1229
Solvent DMSO-d6
Source Vendor ID: NMR/8267980; Lab Info: ZIU; Lab Number: ZIU/0022962