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2H-pyrido[1,2-a][1,3,5]triazine-9-carboxylic acid, 7-cyano-1,3,4,6-tetrahydro-3-(phenylmethyl)-6-thioxo-, ethyl ester
SpectraBase Compound ID 4ZngCmlrVFV
InChI InChI=1S/C18H18N4O2S/c1-2-24-18(23)15-8-14(9-19)17(25)22-12-21(11-20-16(15)22)10-13-6-4-3-5-7-13/h3-8,20H,2,10-12H2,1H3
InChIKey XUUPWGPPYPXXLC-UHFFFAOYSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CTLDSLVN1Br
Name 2H-pyrido[1,2-a][1,3,5]triazine-9-carboxylic acid, 7-cyano-1,3,4,6-tetrahydro-3-(phenylmethyl)-6-thioxo-, ethyl 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/C18H18N4O2S/c1-2-24-18(23)15-8-14(9-19)17(25)22-12-21(11-20-16(15)22)10-13-6-4-3-5-7-13/h3-8,20H,2,10-12H2,1H3
InChIKey XUUPWGPPYPXXLC-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2261
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: F14606; Labnumber: ULSK3-3365