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2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-(3-nitrophenyl)-1(2H)-phthalazinone
SpectraBase Compound ID 3zKwNyPmjLd
InChI InChI=1S/C21H21N5O4/c1-23-9-11-24(12-10-23)19(27)14-25-21(28)18-8-3-2-7-17(18)20(22-25)15-5-4-6-16(13-15)26(29)30/h2-8,13H,9-12,14H2,1H3
InChIKey ROHZGOWWHJTBGE-UHFFFAOYSA-N
Mol Weight 407.43 g/mol
Molecular Formula C21H21N5O4
Exact Mass 407.159354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BAga5G1yXFk
Name 2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-(3-nitrophenyl)-1(2H)-phthalazinone
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/C21H21N5O4/c1-23-9-11-24(12-10-23)19(27)14-25-21(28)18-8-3-2-7-17(18)20(22-25)15-5-4-6-16(13-15)26(29)30/h2-8,13H,9-12,14H2,1H3
InChIKey ROHZGOWWHJTBGE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22223
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: D59119; Labnumber: RRAZ-1300; SBI_ID: SBI-022227
Temperature 318 °C