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isopropyl 2-[(3-chlorobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 7SeCBUbuqu
InChI InChI=1S/C20H22ClNO3S/c1-11(2)25-20(24)17-15-8-7-12(3)9-16(15)26-19(17)22-18(23)13-5-4-6-14(21)10-13/h4-6,10-12H,7-9H2,1-3H3,(H,22,23)
InChIKey QLKBWBQFNQRHGP-UHFFFAOYSA-N
Mol Weight 391.91 g/mol
Molecular Formula C20H22ClNO3S
Exact Mass 391.100892 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JtkbJg0YYgi
Name isopropyl 2-[(3-chlorobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C20H22ClNO3S/c1-11(2)25-20(24)17-15-8-7-12(3)9-16(15)26-19(17)22-18(23)13-5-4-6-14(21)10-13/h4-6,10-12H,7-9H2,1-3H3,(H,22,23)
InChIKey QLKBWBQFNQRHGP-UHFFFAOYSA-N
NMR Offset 14.4753
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UZI_26187_13760
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/8124060; Labnumber: NSB0042210; UZI_ID: UZI-013764
Temperature 313 °C