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6-methyl-3-[4-methyl-3-(4-morpholinylsulfonyl)phenyl][1,2,4]triazolo[3,4-a]phthalazine
SpectraBase Compound ID 8VEAxRjSozC
InChI InChI=1S/C21H21N5O3S/c1-14-7-8-16(13-19(14)30(27,28)25-9-11-29-12-10-25)20-22-23-21-18-6-4-3-5-17(18)15(2)24-26(20)21/h3-8,13H,9-12H2,1-2H3
InChIKey BBDQXPJNUGFSFG-UHFFFAOYSA-N
Mol Weight 423.49 g/mol
Molecular Formula C21H21N5O3S
Exact Mass 423.136511 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3uyq7HaO24p
Name 6-methyl-3-[4-methyl-3-(4-morpholinylsulfonyl)phenyl][1,2,4]triazolo[3,4-a]phthalazine
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/C21H21N5O3S/c1-14-7-8-16(13-19(14)30(27,28)25-9-11-29-12-10-25)20-22-23-21-18-6-4-3-5-17(18)15(2)24-26(20)21/h3-8,13H,9-12H2,1-2H3
InChIKey BBDQXPJNUGFSFG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23969
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: D44014; Labnumber: RRAZ-1410; SBI_ID: SBI-023973
Temperature 300 °C