2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-1,2,3,4-tetrahydroisoquinoline

SpectraBase Compound ID	LlpFqtZzKwT
InChI	InChI=1S/C16H15BrF3N3O/c1-10-14(17)15(16(18,19)20)21-23(10)9-13(24)22-7-6-11-4-2-3-5-12(11)8-22/h2-5H,6-9H2,1H3
InChIKey	KVOUPYWUBUIKJL-UHFFFAOYSA-N Google Search
Mol Weight	402.22 g/mol
Molecular Formula	C16H15BrF3N3O
Exact Mass	401.03506 g/mol

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SpectraBase Spectrum ID	5AfP8sdTVob
Name	2-{[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}-1,2,3,4-tetrahydroisoquinoline
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/C16H15BrF3N3O/c1-10-14(17)15(16(18,19)20)21-23(10)9-13(24)22-7-6-11-4-2-3-5-12(11)8-22/h2-5H,6-9H2,1H3
InChIKey	KVOUPYWUBUIKJL-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_16099
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: UZI/8070011; UBI_ID: UBI-016102
Temperature	308 °C