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1-(5-chloro-2-methylphenyl)-4-(methylsulfonyl)piperazine
SpectraBase Compound ID I2CpzYz39f0
InChI InChI=1S/C12H17ClN2O2S/c1-10-3-4-11(13)9-12(10)14-5-7-15(8-6-14)18(2,16)17/h3-4,9H,5-8H2,1-2H3
InChIKey GKJSEQLYEXRVOH-UHFFFAOYSA-N
Mol Weight 288.79 g/mol
Molecular Formula C12H17ClN2O2S
Exact Mass 288.069927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5IF0KYIryJS
Name 1-(5-chloro-2-methylphenyl)-4-(methylsulfonyl)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/C12H17ClN2O2S/c1-10-3-4-11(13)9-12(10)14-5-7-15(8-6-14)18(2,16)17/h3-4,9H,5-8H2,1-2H3
InChIKey GKJSEQLYEXRVOH-UHFFFAOYSA-N
NMR Offset 17.9098
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_29718
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: 1097175; SBI_ID: SBI-029722
Temperature 303 °C