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(4Z)-4-(4-bromobenzylidene)-3,4-dihydro-1-benzothiepin-5(2H)-one 1,1-dioxide

View entire compound with spectra: 1 NMR

(4Z)-4-(4-bromobenzylidene)-3,4-dihydro-1-benzothiepin-5(2H)-one 1,1-dioxide
SpectraBase Compound ID 7x2qYsMZ22D
InChI InChI=1S/C17H13BrO3S/c18-14-7-5-12(6-8-14)11-13-9-10-22(20,21)16-4-2-1-3-15(16)17(13)19/h1-8,11H,9-10H2/b13-11-
InChIKey CZQZNRXZQLYKCU-QBFSEMIESA-N
Mol Weight 377.25 g/mol
Molecular Formula C17H13BrO3S
Exact Mass 375.976878 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GIln4eQXTxS
Name (4Z)-4-(4-bromobenzylidene)-3,4-dihydro-1-benzothiepin-5(2H)-one 1,1-dioxide
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/C17H13BrO3S/c18-14-7-5-12(6-8-14)11-13-9-10-22(20,21)16-4-2-1-3-15(16)17(13)19/h1-8,11H,9-10H2/b13-11-
InChIKey CZQZNRXZQLYKCU-QBFSEMIESA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2159
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: S18303UKH-0249; Labnumber: S18303UKH-0249; VK_ID: VK-002160
Synonyms 4-(4-bromobenzylidene)-3,4-dihydro-1-benzothiepin-5(2H)-one 1,1-dioxide
Temperature 315 °C