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4-{4-[(2-methoxyethyl)amino]-3-nitrophenyl}-2-methyl-1(2H)-phthalazinone
SpectraBase Compound ID 1CTILOrOeTo
InChI InChI=1S/C18H18N4O4/c1-21-18(23)14-6-4-3-5-13(14)17(20-21)12-7-8-15(19-9-10-26-2)16(11-12)22(24)25/h3-8,11,19H,9-10H2,1-2H3
InChIKey IMOQBLIKAYXTAO-UHFFFAOYSA-N
Mol Weight 354.37 g/mol
Molecular Formula C18H18N4O4
Exact Mass 354.132805 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JoQQVIBNZqn
Name 4-{4-[(2-methoxyethyl)amino]-3-nitrophenyl}-2-methyl-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/C18H18N4O4/c1-21-18(23)14-6-4-3-5-13(14)17(20-21)12-7-8-15(19-9-10-26-2)16(11-12)22(24)25/h3-8,11,19H,9-10H2,1-2H3
InChIKey IMOQBLIKAYXTAO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15998
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: D09534; Labnumber: RRAZ1-3356; SBI_ID: SBI-016001
Temperature 318 °C