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N-[1-(hydroxymethyl)propyl]-4-methoxy-3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
SpectraBase Compound ID 3YHrvrOAh9X
InChI InChI=1S/C21H23N5O4S/c1-4-14(12-27)25-31(28,29)15-9-10-19(30-3)18(11-15)21-23-22-20-17-8-6-5-7-16(17)13(2)24-26(20)21/h5-11,14,25,27H,4,12H2,1-3H3
InChIKey FOFSICPUCQWEBF-UHFFFAOYSA-N
Mol Weight 441.51 g/mol
Molecular Formula C21H23N5O4S
Exact Mass 441.147075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BL3NS8GdseU
Name N-[1-(hydroxymethyl)propyl]-4-methoxy-3-(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/C21H23N5O4S/c1-4-14(12-27)25-31(28,29)15-9-10-19(30-3)18(11-15)21-23-22-20-17-8-6-5-7-16(17)13(2)24-26(20)21/h5-11,14,25,27H,4,12H2,1-3H3
InChIKey FOFSICPUCQWEBF-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10463
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: D79821; Labnumber: RRAZ-4147; SBI_ID: SBI-010466
Temperature 315 °C