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1,2,4-triazine-3,5(2H,4H)-dione, 6-[[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thio]-
SpectraBase Compound ID 2CAXDBnxK8N
InChI InChI=1S/C12H9N5O3S/c18-9-5-7(13-8-3-1-2-4-17(8)9)6-21-11-10(19)14-12(20)16-15-11/h1-5H,6H2,(H2,14,16,19,20)
InChIKey ZCELNZVYIPGPML-UHFFFAOYSA-N
Mol Weight 303.3 g/mol
Molecular Formula C12H9N5O3S
Exact Mass 303.04261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 64ZO6mEij8W
Name 1,2,4-triazine-3,5(2H,4H)-dione, 6-[[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]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 303.042610341 u
Formula C12H9N5O3S
InChI InChI=1S/C12H9N5O3S/c18-9-5-7(13-8-3-1-2-4-17(8)9)6-21-11-10(19)14-12(20)16-15-11/h1-5H,6H2,(H2,14,16,19,20)
InChIKey ZCELNZVYIPGPML-UHFFFAOYSA-N
Molecular Weight 303.296 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_9045
Solvent DMSO-d6
Source Vendor ID: NMR/14228226