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3-(4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl)propanoic acid

View entire compound with spectra: 1 NMR

3-(4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl)propanoic acid
SpectraBase Compound ID GBUESN7RxUO
InChI InChI=1S/C11H10N2O3S/c14-9(15)5-6-13-10(16)7-3-1-2-4-8(7)12-11(13)17/h1-4H,5-6H2,(H,12,17)(H,14,15)
InChIKey XUCGMSJYHMYNPM-UHFFFAOYSA-N
Mol Weight 250.27 g/mol
Molecular Formula C11H10N2O3S
Exact Mass 250.041213 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dmiTFPYPMx
Name 3-(4-oxo-2-thioxo-1,4-dihydro-3(2H)-quinazolinyl)propanoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.041213361 u
Formula C11H10N2O3S
InChI InChI=1S/C11H10N2O3S/c14-9(15)5-6-13-10(16)7-3-1-2-4-8(7)12-11(13)17/h1-4H,5-6H2,(H,12,17)(H,14,15)
InChIKey XUCGMSJYHMYNPM-UHFFFAOYSA-N
Molecular Weight 250.272 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4940
Solvent DMSO-d6
Source Vendor ID: NMR/12318119