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4-{5-[(Z)-(1-allyl-2,5-dioxo-4-imidazolidinylidene)methyl]-2-furyl}-3-methylbenzoic acid
SpectraBase Compound ID gPxQihIqxI
InChI InChI=1S/C19H16N2O5/c1-3-8-21-17(22)15(20-19(21)25)10-13-5-7-16(26-13)14-6-4-12(18(23)24)9-11(14)2/h3-7,9-10H,1,8H2,2H3,(H,20,25)(H,23,24)/b15-10-
InChIKey IUUFIWYGOFJTLQ-GDNBJRDFSA-N
Mol Weight 352.35 g/mol
Molecular Formula C19H16N2O5
Exact Mass 352.105922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L5yojhO0oir
Name 4-{5-[(Z)-(1-allyl-2,5-dioxo-4-imidazolidinylidene)methyl]-2-furyl}-3-methylbenzoic 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/C19H16N2O5/c1-3-8-21-17(22)15(20-19(21)25)10-13-5-7-16(26-13)14-6-4-12(18(23)24)9-11(14)2/h3-7,9-10H,1,8H2,2H3,(H,20,25)(H,23,24)/b15-10-
InChIKey IUUFIWYGOFJTLQ-GDNBJRDFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8342
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: D36149; Labnumber: SPDEM5-37825; SBI_ID: SBI-008345
Synonyms 4-{5-[(1-allyl-2,5-dioxo-4-imidazolidinylidene)methyl]-2-furyl}-3-methylbenzoic acid
Temperature 318 °C