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9-methoxy-3-{[(E)-(4-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
SpectraBase Compound ID 8WfSoAuVwl6
InChI InChI=1S/C18H13N5O5/c1-28-13-4-2-3-12-14(13)15-16(20-12)17(24)22(18(25)21-15)19-9-10-5-7-11(8-6-10)23(26)27/h2-9,20H,1H3,(H,21,25)/b19-9+
InChIKey WHGQJQGUQXMBDT-DJKKODMXSA-N
Mol Weight 379.33 g/mol
Molecular Formula C18H13N5O5
Exact Mass 379.091669 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID El9dWuEvHhO
Name 9-methoxy-3-{[(E)-(4-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H13N5O5/c1-28-13-4-2-3-12-14(13)15-16(20-12)17(24)22(18(25)21-15)19-9-10-5-7-11(8-6-10)23(26)27/h2-9,20H,1H3,(H,21,25)/b19-9+
InChIKey WHGQJQGUQXMBDT-DJKKODMXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18216
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: D32067; Labnumber: SIMAK-01534; SBI_ID: SBI-018219
Synonyms 9-methoxy-3-{[(4-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Temperature 308 °C