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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9INyrokn4eh
Name 4-(Methylthio)benzonitrile
Appearance Slight yellow solid
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 149.029920403 u
Formula C8H7NS
InChI InChI=1S/C8H7NS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,1H3
InChIKey RPVGEEHGKIFQFO-UHFFFAOYSA-N
Instrument Name Agilent 6890N GC-5975 MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201705326
Molecular Weight 149.211 g/mol
Quality 204
SMILES CSC1=CC=C(C=C1)C#N
SPLASH splash10-0002-0900000000-b6ca4816203a9ca735e0
Source of Spectrum QE-24-SM12-12-1 (DOI: 10.1002/chem.201705326)
Wiley ID 1901407