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[1,2,4]triazolo[1,5-a]pyrimidine-5-acetic acid, 4,7-dihydro-2-(methylthio)-7-oxo-, methyl ester
SpectraBase Compound ID AFlXeTnrteu
InChI InChI=1S/C9H10N4O3S/c1-16-7(15)4-5-3-6(14)13-8(10-5)11-9(12-13)17-2/h3H,4H2,1-2H3,(H,10,11,12)
InChIKey BSIMRPDZGPNHRU-UHFFFAOYSA-N
Mol Weight 254.26 g/mol
Molecular Formula C9H10N4O3S
Exact Mass 254.047361 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JPhc0demlnz
Name [1,2,4]triazolo[1,5-a]pyrimidine-5-acetic acid, 4,7-dihydro-2-(methylthio)-7-oxo-, 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/C9H10N4O3S/c1-16-7(15)4-5-3-6(14)13-8(10-5)11-9(12-13)17-2/h3H,4H2,1-2H3,(H,10,11,12)
InChIKey BSIMRPDZGPNHRU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_973
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: F06886; Labnumber: VGU-S0022-0593
Temperature 308 °C