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isopropyl 2-[(4-chlorobutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID IFZIQ382ulH
InChI InChI=1S/C16H22ClNO3S/c1-10(2)21-16(20)14-11-6-3-4-7-12(11)22-15(14)18-13(19)8-5-9-17/h10H,3-9H2,1-2H3,(H,18,19)
InChIKey DYJIJHGSTXBYRF-UHFFFAOYSA-N
Mol Weight 343.87 g/mol
Molecular Formula C16H22ClNO3S
Exact Mass 343.100892 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID QgpYcrTLV5
Name isopropyl 2-[(4-chlorobutanoyl)amino]-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/C16H22ClNO3S/c1-10(2)21-16(20)14-11-6-3-4-7-12(11)22-15(14)18-13(19)8-5-9-17/h10H,3-9H2,1-2H3,(H,18,19)
InChIKey DYJIJHGSTXBYRF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_17670
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/9064577; UBI_ID: UBI-017673
Temperature 318 °C