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3-{[(E)-(3-chlorophenyl)methylidene]amino}-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
SpectraBase Compound ID 81Ny25VaJHt
InChI InChI=1S/C18H13ClN4O2/c1-25-13-5-6-14-15(8-13)22-17-16(14)20-10-23(18(17)24)21-9-11-3-2-4-12(19)7-11/h2-10,22H,1H3/b21-9+
InChIKey BJABJGQRSXEIJM-ZVBGSRNCSA-N
Mol Weight 352.78 g/mol
Molecular Formula C18H13ClN4O2
Exact Mass 352.072703 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CRK8Y4kSTBU
Name 3-{[(E)-(3-chlorophenyl)methylidene]amino}-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
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/C18H13ClN4O2/c1-25-13-5-6-14-15(8-13)22-17-16(14)20-10-23(18(17)24)21-9-11-3-2-4-12(19)7-11/h2-10,22H,1H3/b21-9+
InChIKey BJABJGQRSXEIJM-ZVBGSRNCSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16318
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: D22814; Labnumber: SIMAK02-00062; SBI_ID: SBI-016321
Synonyms 3-{[(3-chlorophenyl)methylidene]amino}-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Temperature 308 °C