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3-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-6-methyl[1,2,4]triazolo[3,4-a]phthalazine
SpectraBase Compound ID E5Og7AWbpHP
InChI InChI=1S/C22H23N5O3S/c1-15-17-8-4-5-9-18(17)21-23-24-22(27(21)25-15)19-14-16(10-11-20(19)30-2)31(28,29)26-12-6-3-7-13-26/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3
InChIKey HNORAGPOODCDNS-UHFFFAOYSA-N
Mol Weight 437.52 g/mol
Molecular Formula C22H23N5O3S
Exact Mass 437.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K8Ou6pJxW9P
Name 3-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-6-methyl[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/C22H23N5O3S/c1-15-17-8-4-5-9-18(17)21-23-24-22(27(21)25-15)19-14-16(10-11-20(19)30-2)31(28,29)26-12-6-3-7-13-26/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3
InChIKey HNORAGPOODCDNS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11779
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: D63927; Labnumber: RRAZ-4144; SBI_ID: SBI-011782
Synonyms methyl 2-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-4-(1-piperidinylsulfonyl)phenyl ether
Temperature 318 °C