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(4E)-4-(1,3-benzodioxol-5-ylmethylene)-3-(4-chlorophenyl)-5(4H)-isoxazolone

View entire compound with spectra: 1 NMR

(4E)-4-(1,3-benzodioxol-5-ylmethylene)-3-(4-chlorophenyl)-5(4H)-isoxazolone
SpectraBase Compound ID 2pV4ZpezxMI
InChI InChI=1S/C17H10ClNO4/c18-12-4-2-11(3-5-12)16-13(17(20)23-19-16)7-10-1-6-14-15(8-10)22-9-21-14/h1-8H,9H2/b13-7+
InChIKey BDYAXRKNUFVHHY-NTUHNPAUSA-N
Mol Weight 327.72 g/mol
Molecular Formula C17H10ClNO4
Exact Mass 327.029836 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8yY4bkIM4Wy
Name (4E)-4-(1,3-benzodioxol-5-ylmethylene)-3-(4-chlorophenyl)-5(4H)-isoxazolone
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/C17H10ClNO4/c18-12-4-2-11(3-5-12)16-13(17(20)23-19-16)7-10-1-6-14-15(8-10)22-9-21-14/h1-8H,9H2/b13-7+
InChIKey BDYAXRKNUFVHHY-NTUHNPAUSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13744
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: 200527; Labnumber: SPP-1341; VK_ID: VK-013749
Synonyms 4-(1,3-benzodioxol-5-ylmethylene)-3-(4-chlorophenyl)-5(4H)-isoxazolone
Temperature 308 °C