4-[4-(3,4-dichlorophenyl)-1-piperazinyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole

SpectraBase Compound ID	EwwpB6NAZZR
InChI	InChI=1S/C22H21Cl2N5O2/c1-30-18-10-14-17(11-19(18)31-2)27-21-20(14)25-12-26-22(21)29-7-5-28(6-8-29)13-3-4-15(23)16(24)9-13/h3-4,9-12,27H,5-8H2,1-2H3
InChIKey	QDSRZPONIPNPCL-UHFFFAOYSA-N Google Search
Mol Weight	458.35 g/mol
Molecular Formula	C22H21Cl2N5O2
Exact Mass	457.10723 g/mol

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SpectraBase Spectrum ID	GP829FvRqRs
Name	4-[4-(3,4-dichlorophenyl)-1-piperazinyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
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/C22H21Cl2N5O2/c1-30-18-10-14-17(11-19(18)31-2)27-21-20(14)25-12-26-22(21)29-7-5-28(6-8-29)13-3-4-15(23)16(24)9-13/h3-4,9-12,27H,5-8H2,1-2H3
InChIKey	QDSRZPONIPNPCL-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_21803
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: D55767; Labnumber: Simak-01671; SBI_ID: SBI-021807
Temperature	315 °C