7-[1-acetyl-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-6-chloro[1,3]dioxolo[4,5-g]quinoline

SpectraBase Compound ID	68iy7pSnmED
InChI	InChI=1S/C22H18ClN3O3/c1-12-3-5-14(6-4-12)18-9-19(26(25-18)13(2)27)16-7-15-8-20-21(29-11-28-20)10-17(15)24-22(16)23/h3-8,10,19H,9,11H2,1-2H3
InChIKey	UCCKEXFSEVWSDE-UHFFFAOYSA-N Google Search
Mol Weight	407.86 g/mol
Molecular Formula	C22H18ClN3O3
Exact Mass	407.103669 g/mol

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SpectraBase Spectrum ID	JuuARl8t90Z
Name	7-[1-acetyl-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-5-yl]-6-chloro[1,3]dioxolo[4,5-g]quinoline
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/C22H18ClN3O3/c1-12-3-5-14(6-4-12)18-9-19(26(25-18)13(2)27)16-7-15-8-20-21(29-11-28-20)10-17(15)24-22(16)23/h3-8,10,19H,9,11H2,1-2H3
InChIKey	UCCKEXFSEVWSDE-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_2443
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: D03017; Labnumber: EXVost5-0082; SBI_ID: SBI-002445
Temperature	303 °C