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isopropyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID EDD7ZMFdbiB
InChI InChI=1S/C20H21NO5S/c1-11(2)26-20(23)17-13-5-3-4-6-16(13)27-19(17)21-18(22)12-7-8-14-15(9-12)25-10-24-14/h7-9,11H,3-6,10H2,1-2H3,(H,21,22)
InChIKey COVMLLNVWXBYEF-UHFFFAOYSA-N
Mol Weight 387.45 g/mol
Molecular Formula C20H21NO5S
Exact Mass 387.114044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HSU2jU1wldv
Name isopropyl 2-[(1,3-benzodioxol-5-ylcarbonyl)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/C20H21NO5S/c1-11(2)26-20(23)17-13-5-3-4-6-16(13)27-19(17)21-18(22)12-7-8-14-15(9-12)25-10-24-14/h7-9,11H,3-6,10H2,1-2H3,(H,21,22)
InChIKey COVMLLNVWXBYEF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_12101
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/6224924; Labnumber: NSB0004694; UZI_ID: UZI-012104
Temperature 318 °C