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4-{4-[(3-hydroxypropyl)amino]-3-nitrophenyl}-2-methyl-1(2H)-phthalazinone
SpectraBase Compound ID FgtyX8iZ61B
InChI InChI=1S/C18H18N4O4/c1-21-18(24)14-6-3-2-5-13(14)17(20-21)12-7-8-15(19-9-4-10-23)16(11-12)22(25)26/h2-3,5-8,11,19,23H,4,9-10H2,1H3
InChIKey CXZQQGAELGAKMH-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 KHMKL7zlFc6
Name 4-{4-[(3-hydroxypropyl)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(24)14-6-3-2-5-13(14)17(20-21)12-7-8-15(19-9-4-10-23)16(11-12)22(25)26/h2-3,5-8,11,19,23H,4,9-10H2,1H3
InChIKey CXZQQGAELGAKMH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15996
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: D09532; Labnumber: RRAZ1-3354; SBI_ID: SBI-015999
Temperature 318 °C