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(p-tolylsulfonyl)acetonitrile

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 MS (GC)

(p-tolylsulfonyl)acetonitrile
SpectraBase Compound ID 2fr6yf4RKfb
InChI InChI=1S/C9H9NO2S/c1-8-2-4-9(5-3-8)13(11,12)7-6-10/h2-5H,7H2,1H3
InChIKey BBNNLJMGPASZPD-UHFFFAOYSA-N
Mol Weight 195.24 g/mol
Molecular Formula C9H9NO2S
Exact Mass 195.0354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AtaL7ZqLhp8
Name acetonitrile, [(4-methylphenyl)sulfonyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.035399706 u
Formula C9H9NO2S
InChI InChI=1S/C9H9NO2S/c1-8-2-4-9(5-3-8)13(11,12)7-6-10/h2-5H,7H2,1H3
InChIKey BBNNLJMGPASZPD-UHFFFAOYSA-N
Molecular Weight 195.236 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_40
Solvent DMSO-d6
Source Vendor ID: NMR/13238385