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6H-pyrimido[1,2-a][1,3,5]triazin-6-one, 2-[4-(3-chlorophenyl)-1-piperazinyl]-1,4-dihydro-8-methyl-4-(3-pyridinyl)-
SpectraBase Compound ID HxoBqiGbcyZ
InChI InChI=1S/C22H22ClN7O/c1-15-12-19(31)30-20(16-4-3-7-24-14-16)26-21(27-22(30)25-15)29-10-8-28(9-11-29)18-6-2-5-17(23)13-18/h2-7,12-14,20H,8-11H2,1H3,(H,25,26,27)
InChIKey UPVFYRHVRHXCBE-UHFFFAOYSA-N
Mol Weight 435.92 g/mol
Molecular Formula C22H22ClN7O
Exact Mass 435.157436 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H05SfjjeEGI
Name 6H-pyrimido[1,2-a][1,3,5]triazin-6-one, 2-[4-(3-chlorophenyl)-1-piperazinyl]-1,4-dihydro-8-methyl-4-(3-pyridinyl)-
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/C22H22ClN7O/c1-15-12-19(31)30-20(16-4-3-7-24-14-16)26-21(27-22(30)25-15)29-10-8-28(9-11-29)18-6-2-5-17(23)13-18/h2-7,12-14,20H,8-11H2,1H3,(H,25,26,27)
InChIKey UPVFYRHVRHXCBE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3751
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: F18166; Labnumber: VGU-112045