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

SpectraBase Compound ID	ITaI3U0FlbN
InChI	InChI=1S/C27H32N4O2/c1-2-3-4-5-6-7-8-11-18-33-22-16-14-21(15-17-22)19-29-31-20-28-25-23-12-9-10-13-24(23)30-26(25)27(31)32/h9-10,12-17,19-20,30H,2-8,11,18H2,1H3/b29-19+
InChIKey	NRKBSAIZMBPFRO-VUTHCHCSSA-N Google Search
Mol Weight	444.6 g/mol
Molecular Formula	C27H32N4O2
Exact Mass	444.252526 g/mol

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SpectraBase Spectrum ID	KF5tWsFgINb
Name	3-({(E)-[4-(decyloxy)phenyl]methylidene}amino)-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/C27H32N4O2/c1-2-3-4-5-6-7-8-11-18-33-22-16-14-21(15-17-22)19-29-31-20-28-25-23-12-9-10-13-24(23)30-26(25)27(31)32/h9-10,12-17,19-20,30H,2-8,11,18H2,1H3/b29-19+
InChIKey	NRKBSAIZMBPFRO-VUTHCHCSSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_13440
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: 102010; Labnumber: PRBS13-15076; VK_ID: VK-013445
Synonyms	3-({[4-(decyloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Temperature	308 °C