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piperazine, 1-[(4-methylphenyl)sulfonyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID HG5wA4eiAq1
InChI InChI=1S/C18H18F3N3O4S/c1-13-2-5-15(6-3-13)29(27,28)23-10-8-22(9-11-23)16-7-4-14(18(19,20)21)12-17(16)24(25)26/h2-7,12H,8-11H2,1H3
InChIKey NGWOXLWQPABTCM-UHFFFAOYSA-N
Mol Weight 429.41 g/mol
Molecular Formula C18H18F3N3O4S
Exact Mass 429.097012 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JNesu2zl0UF
Name piperazine, 1-[(4-methylphenyl)sulfonyl]-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 429.097011731 u
Formula C18H18F3N3O4S
InChI InChI=1S/C18H18F3N3O4S/c1-13-2-5-15(6-3-13)29(27,28)23-10-8-22(9-11-23)16-7-4-14(18(19,20)21)12-17(16)24(25)26/h2-7,12H,8-11H2,1H3
InChIKey NGWOXLWQPABTCM-UHFFFAOYSA-N
Molecular Weight 429.414 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7102
Solvent DMSO-d6
Source Vendor ID: NMR/10220704; Lab Info: LP; Lab Number: LP-2501200
Temperature 29.85 °C