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4-(4-morpholinyl)-5-nitrophthalonitrile

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4-(4-morpholinyl)-5-nitrophthalonitrile
SpectraBase Compound ID 3Mcsjjarcgj
InChI InChI=1S/C12H10N4O3/c13-7-9-5-11(15-1-3-19-4-2-15)12(16(17)18)6-10(9)8-14/h5-6H,1-4H2
InChIKey SQJCBBDYGBLGAY-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ida1I36CGOk
Name 4-(4-morpholinyl)-5-nitrophthalonitrile
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/C12H10N4O3/c13-7-9-5-11(15-1-3-19-4-2-15)12(16(17)18)6-10(9)8-14/h5-6H,1-4H2
InChIKey SQJCBBDYGBLGAY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_1002
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: NMR/8241686; Labnumber: AIS-44; IOH_ID: IOH-001003
Temperature 303 °C