For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
isopropyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(3-bromophenyl)-3-thiophenecarboxylate
SpectraBase Compound ID AIEiisXxB5q
InChI InChI=1S/C22H18BrNO5S/c1-12(2)29-22(26)19-16(13-4-3-5-15(23)8-13)10-30-21(19)24-20(25)14-6-7-17-18(9-14)28-11-27-17/h3-10,12H,11H2,1-2H3,(H,24,25)
InChIKey UGRNSHSKBXXKON-UHFFFAOYSA-N
Mol Weight 488.35 g/mol
Molecular Formula C22H18BrNO5S
Exact Mass 487.008907 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EPz1NkDdWg5
Name isopropyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(3-bromophenyl)-3-thiophenecarboxylate
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/C22H18BrNO5S/c1-12(2)29-22(26)19-16(13-4-3-5-15(23)8-13)10-30-21(19)24-20(25)14-6-7-17-18(9-14)28-11-27-17/h3-10,12H,11H2,1-2H3,(H,24,25)
InChIKey UGRNSHSKBXXKON-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20343
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/9154457; Labnumber: U_AM_ACK/039700; UZI_ID: UZI-020351
Temperature 318 °C