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acetic acid, [[2-[(phenylmethyl)thio]-4-quinazolinyl]thio]-
SpectraBase Compound ID 5JFyMq719TS
InChI InChI=1S/C17H14N2O2S2/c20-15(21)11-22-16-13-8-4-5-9-14(13)18-17(19-16)23-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)
InChIKey HLDLEGJNNPTFKH-UHFFFAOYSA-N
Mol Weight 342.43 g/mol
Molecular Formula C17H14N2O2S2
Exact Mass 342.04967 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D0KfvPRDlXh
Name acetic acid, [[2-[(phenylmethyl)thio]-4-quinazolinyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.049670045 u
Formula C17H14N2O2S2
InChI InChI=1S/C17H14N2O2S2/c20-15(21)11-22-16-13-8-4-5-9-14(13)18-17(19-16)23-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)
InChIKey HLDLEGJNNPTFKH-UHFFFAOYSA-N
Molecular Weight 342.431 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15861
Solvent DMSO-d6
Source Vendor ID: NMR/11221070; Lab Info: JSA; Lab Number: JSA-0000369