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N-butyl-2-methoxy-N-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
SpectraBase Compound ID KPH5zJNiNCS
InChI InChI=1S/C22H25N5O3S/c1-5-6-13-26(3)31(28,29)20-14-16(11-12-19(20)30-4)21-23-24-22-18-10-8-7-9-17(18)15(2)25-27(21)22/h7-12,14H,5-6,13H2,1-4H3
InChIKey DNPPQGYHEYSVOO-UHFFFAOYSA-N
Mol Weight 439.53 g/mol
Molecular Formula C22H25N5O3S
Exact Mass 439.167811 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 15lmymjlAVG
Name N-butyl-2-methoxy-N-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
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/C22H25N5O3S/c1-5-6-13-26(3)31(28,29)20-14-16(11-12-19(20)30-4)21-23-24-22-18-10-8-7-9-17(18)15(2)25-27(21)22/h7-12,14H,5-6,13H2,1-4H3
InChIKey DNPPQGYHEYSVOO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21261
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: D52551; Labnumber: RRAZ-1433; SBI_ID: SBI-021265
Temperature 318 °C