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4-CYANO-THIO-ANISOLE

View entire compound with spectra: 7 NMR, 3 FTIR, and 4 MS (GC)

4-CYANO-THIO-ANISOLE
SpectraBase Compound ID 9zS7NRVrs8o
InChI InChI=1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKey RPVGEEHGKIFQFO-UHFFFAOYSA-N
Mol Weight 149.21 g/mol
Molecular Formula C8H7NS
Exact Mass 149.02992 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9kTsWgokMrM
Name 4-(Methylthio)benzonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 279684
CAS Registry Number 21382-98-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NS
InChI InChI=1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKey RPVGEEHGKIFQFO-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_005124