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4-thiazoleacetic acid, 2-[[(1-oxo-4-phenyl-1H-2-benzopyran-3-yl)carbonyl]amino]-, ethyl ester
SpectraBase Compound ID JjDEhZHMmIF
InChI InChI=1S/C23H18N2O5S/c1-2-29-18(26)12-15-13-31-23(24-15)25-21(27)20-19(14-8-4-3-5-9-14)16-10-6-7-11-17(16)22(28)30-20/h3-11,13H,2,12H2,1H3,(H,24,25,27)
InChIKey MGKFUAILPKJWMK-UHFFFAOYSA-N
Mol Weight 434.47 g/mol
Molecular Formula C23H18N2O5S
Exact Mass 434.093643 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GKsLC6d7Cvc
Name 4-thiazoleacetic acid, 2-[[(1-oxo-4-phenyl-1H-2-benzopyran-3-yl)carbonyl]amino]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.093642857 u
Formula C23H18N2O5S
InChI InChI=1S/C23H18N2O5S/c1-2-29-18(26)12-15-13-31-23(24-15)25-21(27)20-19(14-8-4-3-5-9-14)16-10-6-7-11-17(16)22(28)30-20/h3-11,13H,2,12H2,1H3,(H,24,25,27)
InChIKey MGKFUAILPKJWMK-UHFFFAOYSA-N
Molecular Weight 434.466 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5569
Solvent DMSO-d6
Source Vendor ID: NMR/13288951