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3-({2-methoxy-4-[(E)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
SpectraBase Compound ID E1PQWOoVe58
InChI InChI=1S/C20H17NO6S/c1-21-18(22)17(28-20(21)25)10-12-6-7-15(16(9-12)26-2)27-11-13-4-3-5-14(8-13)19(23)24/h3-10H,11H2,1-2H3,(H,23,24)/b17-10+
InChIKey XREWGPMRYPRHNP-LICLKQGHSA-N
Mol Weight 399.42 g/mol
Molecular Formula C20H17NO6S
Exact Mass 399.077658 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5oX6pn8K7Ao
Name 3-({2-methoxy-4-[(E)-(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
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/C20H17NO6S/c1-21-18(22)17(28-20(21)25)10-12-6-7-15(16(9-12)26-2)27-11-13-4-3-5-14(8-13)19(23)24/h3-10H,11H2,1-2H3,(H,23,24)/b17-10+
InChIKey XREWGPMRYPRHNP-LICLKQGHSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10138
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: 1001335; UBI_ID: UBI-010141
Synonyms 3-({2-methoxy-4-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzoic acid
Temperature 315 °C