1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine

SpectraBase Compound ID	8LVLKDH7Bt9
InChI	InChI=1S/C17H13ClF6N4O2/c18-12-7-11(17(22,23)24)9-25-15(12)27-5-3-26(4-6-27)13-2-1-10(16(19,20)21)8-14(13)28(29)30/h1-2,7-9H,3-6H2
InChIKey	FZDRPGIBMPULJF-UHFFFAOYSA-N Google Search
Mol Weight	454.76 g/mol
Molecular Formula	C17H13ClF6N4O2
Exact Mass	454.063122 g/mol

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SpectraBase Spectrum ID	GYL13TQVp8c
Name	piperazine, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	454.063122351 u
Formula	C17H13ClF6N4O2
InChI	InChI=1S/C17H13ClF6N4O2/c18-12-7-11(17(22,23)24)9-25-15(12)27-5-3-26(4-6-27)13-2-1-10(16(19,20)21)8-14(13)28(29)30/h1-2,7-9H,3-6H2
InChIKey	FZDRPGIBMPULJF-UHFFFAOYSA-N
Molecular Weight	454.760 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_15875
Solvent	DMSO-d6
Source	Vendor ID: NMR/10301492; Lab Info: SIP; Lab Number: SIP-0051