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piperazine, 1-(methylsulfonyl)-4-[4-nitro-2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID CwWHyF1HjgM
InChI InChI=1S/C12H14F3N3O4S/c1-23(21,22)17-6-4-16(5-7-17)11-3-2-9(18(19)20)8-10(11)12(13,14)15/h2-3,8H,4-7H2,1H3
InChIKey ZCONTSDWPUPKJQ-UHFFFAOYSA-N
Mol Weight 353.32 g/mol
Molecular Formula C12H14F3N3O4S
Exact Mass 353.065712 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ylsdp73HXP
Name piperazine, 1-(methylsulfonyl)-4-[4-nitro-2-(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 353.065711602 u
Formula C12H14F3N3O4S
InChI InChI=1S/C12H14F3N3O4S/c1-23(21,22)17-6-4-16(5-7-17)11-3-2-9(18(19)20)8-10(11)12(13,14)15/h2-3,8H,4-7H2,1H3
InChIKey ZCONTSDWPUPKJQ-UHFFFAOYSA-N
Molecular Weight 353.316 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8035
Solvent DMSO-d6
Source Vendor ID: NMR/9243555; Lab Info: LP; Lab Number: LP-2500932
Temperature 29.85 °C