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4H,5H-pyrano[4,3-b]pyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-
SpectraBase Compound ID 31ciTDk2kgj
InChI InChI=1S/C16H10ClN3O5/c1-7-4-12-14(16(21)24-7)13(9(6-18)15(19)25-12)8-2-3-10(17)11(5-8)20(22)23/h2-5,13H,19H2,1H3
InChIKey AURMXPOPZYMGQV-UHFFFAOYSA-N
Mol Weight 359.73 g/mol
Molecular Formula C16H10ClN3O5
Exact Mass 359.030898 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Efauexw7oxu
Name 4H,5H-pyrano[4,3-b]pyran-3-carbonitrile, 2-amino-4-(4-chloro-3-nitrophenyl)-7-methyl-5-oxo-
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/C16H10ClN3O5/c1-7-4-12-14(16(21)24-7)13(9(6-18)15(19)25-12)8-2-3-10(17)11(5-8)20(22)23/h2-5,13H,19H2,1H3
InChIKey AURMXPOPZYMGQV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1078
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: 63TSH0.190; IOH_ID: IOH-008080