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[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine, N~5~-(2,3-dimethylphenyl)-N~6~-(4-iodophenyl)-
SpectraBase Compound ID KI52poPLisK
InChI InChI=1S/C18H15IN6O/c1-10-4-3-5-14(11(10)2)21-16-15(20-13-8-6-12(19)7-9-13)22-17-18(23-16)25-26-24-17/h3-9H,1-2H3,(H,20,22,24)(H,21,23,25)
InChIKey CGWLMXIBRLXVEU-UHFFFAOYSA-N
Mol Weight 458.26 g/mol
Molecular Formula C18H15IN6O
Exact Mass 458.035204 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CaUKSpVrAXI
Name [1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine, N~5~-(2,3-dimethylphenyl)-N~6~-(4-iodophenyl)-
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/C18H15IN6O/c1-10-4-3-5-14(11(10)2)21-16-15(20-13-8-6-12(19)7-9-13)22-17-18(23-16)25-26-24-17/h3-9H,1-2H3,(H,20,22,24)(H,21,23,25)
InChIKey CGWLMXIBRLXVEU-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1619
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/9213489; Labnumber: LP-3200017
Temperature 297 °C