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4-methyl-2-[(Z)-(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl 4-nitrobenzoate
SpectraBase Compound ID F4ZBxagtxcm
InChI InChI=1S/C23H15NO5S/c1-14-6-11-19(29-23(26)15-7-9-17(10-8-15)24(27)28)16(12-14)13-21-22(25)18-4-2-3-5-20(18)30-21/h2-13H,1H3/b21-13-
InChIKey AMDCMNSDBWMGER-BKUYFWCQSA-N
Mol Weight 417.44 g/mol
Molecular Formula C23H15NO5S
Exact Mass 417.067094 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A2P0BJEUJLh
Name 4-methyl-2-[(Z)-(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl 4-nitrobenzoate
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/C23H15NO5S/c1-14-6-11-19(29-23(26)15-7-9-17(10-8-15)24(27)28)16(12-14)13-21-22(25)18-4-2-3-5-20(18)30-21/h2-13H,1H3/b21-13-
InChIKey AMDCMNSDBWMGER-BKUYFWCQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2878
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: 114453; Labnumber: RRKR1-363; VK_ID: VK-002879
Synonyms 4-methyl-2-[(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl 4-nitrobenzoate
Temperature 318 °C