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3-Thiopheneacetonitrile
SpectraBase Compound ID Kow6Qqc947a
InChI InChI=1S/C6H5NS/c7-3-1-6-2-4-8-5-6/h2,4-5H,1H2
InChIKey GWZCLMWEJWPFFA-UHFFFAOYSA-N
Mol Weight 123.17 g/mol
Molecular Formula C6H5NS
Exact Mass 123.01427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CU8MysDoA2m
Name 3-THIOPHENEACETONITRILE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Exact Mass 123.014270339 u
Formula C6H5NS
InChI InChI=1S/C6H5NS/c7-3-1-6-2-4-8-5-6/h2,4-5H,1H2
InChIKey GWZCLMWEJWPFFA-UHFFFAOYSA-N
Molecular Weight 123.173 g/mol
Nominal Mass 123 u
Number of Peaks 74
SMILES c1(ccsc1)CC#N
SPLASH splash10-00dj-9400000000-6a70fc99c51a1d75662f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX_001566