3-{[(E)-(4-fluorophenyl)methylidene]amino}-9-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

SpectraBase Compound ID	CxU2elEeB3E
InChI	InChI=1S/C18H13FN4O/c1-11-3-2-4-14-15(11)16-17(22-14)18(24)23(10-20-16)21-9-12-5-7-13(19)8-6-12/h2-10,22H,1H3/b21-9+
InChIKey	RJWCNHLEXSKUTF-ZVBGSRNCSA-N Google Search
Mol Weight	320.33 g/mol
Molecular Formula	C18H13FN4O
Exact Mass	320.107339 g/mol

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SpectraBase Spectrum ID	AdU5mS9wZLz
Name	3-{[(E)-(4-fluorophenyl)methylidene]amino}-9-methyl-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/C18H13FN4O/c1-11-3-2-4-14-15(11)16-17(22-14)18(24)23(10-20-16)21-9-12-5-7-13(19)8-6-12/h2-10,22H,1H3/b21-9+
InChIKey	RJWCNHLEXSKUTF-ZVBGSRNCSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13725
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: D88814; Labnumber: SIMAK-01965; SBI_ID: SBI-013728
Synonyms	3-{[(4-fluorophenyl)methylidene]amino}-9-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Temperature	306 °C