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4(1H)-quinazolinone, 2-[(carboxythio)methyl]-
SpectraBase Compound ID 28pAqmk9UmD
InChI InChI=1S/C10H8N2O3S/c13-9-6-3-1-2-4-7(6)11-8(12-9)5-16-10(14)15/h1-4H,5H2,(H,14,15)(H,11,12,13)
InChIKey XNIDBGFRUXIQHS-UHFFFAOYSA-N
Mol Weight 236.24 g/mol
Molecular Formula C10H8N2O3S
Exact Mass 236.025563 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KhTAQC6DzHY
Name 4(1H)-quinazolinone, 2-[(carboxythio)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 236.025563297 u
Formula C10H8N2O3S
InChI InChI=1S/C10H8N2O3S/c13-9-6-3-1-2-4-7(6)11-8(12-9)5-16-10(14)15/h1-4H,5H2,(H,14,15)(H,11,12,13)
InChIKey XNIDBGFRUXIQHS-UHFFFAOYSA-N
Molecular Weight 236.245 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10796
Solvent DMSO-d6
Source Vendor ID: NMR/10252764; Lab Info: JSA; Lab Number: JSA-0000222