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1-(methylsulfonyl)-4-[2-(trifluoromethyl)benzyl]piperazine
SpectraBase Compound ID FBwtJPy9kMN
InChI InChI=1S/C13H17F3N2O2S/c1-21(19,20)18-8-6-17(7-9-18)10-11-4-2-3-5-12(11)13(14,15)16/h2-5H,6-10H2,1H3
InChIKey XLFFPYZXEHNQMD-UHFFFAOYSA-N
Mol Weight 322.35 g/mol
Molecular Formula C13H17F3N2O2S
Exact Mass 322.096283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FcaO6unI30u
Name 1-(methylsulfonyl)-4-[2-(trifluoromethyl)benzyl]piperazine
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/C13H17F3N2O2S/c1-21(19,20)18-8-6-17(7-9-18)10-11-4-2-3-5-12(11)13(14,15)16/h2-5H,6-10H2,1H3
InChIKey XLFFPYZXEHNQMD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13876
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/9317651; UBI_ID: UBI-013879
Temperature 308 °C