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acetic acid, [[2-(4-pyridinyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-, methyl ester
SpectraBase Compound ID Ij4Uszn3oTL
InChI InChI=1S/C17H13N5O2S/c1-24-14(23)10-25-17-19-13-5-3-2-4-12(13)16-20-15(21-22(16)17)11-6-8-18-9-7-11/h2-9H,10H2,1H3
InChIKey CBVPBKZBQOPNFW-UHFFFAOYSA-N
Mol Weight 351.38 g/mol
Molecular Formula C17H13N5O2S
Exact Mass 351.078996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HIpNBOsDV4E
Name acetic acid, [[2-(4-pyridinyl)[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-, methyl ester
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/C17H13N5O2S/c1-24-14(23)10-25-17-19-13-5-3-2-4-12(13)16-20-15(21-22(16)17)11-6-8-18-9-7-11/h2-9H,10H2,1H3
InChIKey CBVPBKZBQOPNFW-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3315
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: F17518; Labnumber: VGU-S1112-0216