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2,8-dioxa-3,7-diazanona-3,6-diene-1,9-diamide, 4,6-diamino-N~1~,N~9~-bis(4-chlorophenyl)-, (3E,6E)-
SpectraBase Compound ID CrgF8aW0zPH
InChI InChI=1S/C17H16Cl2N6O4/c18-10-1-5-12(6-2-10)22-16(26)28-24-14(20)9-15(21)25-29-17(27)23-13-7-3-11(19)4-8-13/h1-8H,9H2,(H2,20,24)(H2,21,25)(H,22,26)(H,23,27)
InChIKey HRIYWCNPAXKEPQ-UHFFFAOYSA-N
Mol Weight 439.26 g/mol
Molecular Formula C17H16Cl2N6O4
Exact Mass 438.061008 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9eYQNbtW0Sn
Name 2,8-dioxa-3,7-diazanona-3,6-diene-1,9-diamide, 4,6-diamino-N~1~,N~9~-bis(4-chlorophenyl)-, (3E,6E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.061008415 u
Formula C17H16Cl2N6O4
InChI InChI=1S/C17H16Cl2N6O4/c18-10-1-5-12(6-2-10)22-16(26)28-24-14(20)9-15(21)25-29-17(27)23-13-7-3-11(19)4-8-13/h1-8H,9H2,(H2,20,24)(H2,21,25)(H,22,26)(H,23,27)
InChIKey HRIYWCNPAXKEPQ-UHFFFAOYSA-N
Molecular Weight 439.259 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6991
Solvent DMSO-d6
Source Vendor ID: NMR/10220482; Lab Info: AU; Lab Number: AU-TG00852
Temperature 23.85 °C