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2-Thiopheneacetonitrile
SpectraBase Compound ID 1WQ0xp7RsrU
InChI InChI=1S/C6H5NS/c7-4-3-6-2-1-5-8-6/h1-2,5H,3H2
InChIKey CLSHQIDDCJTHAJ-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 AqYlmSRn9Lc
Name 2-Thiopheneacetonitrile
Alternate Name(s) 2-(2-Thienyl)acetonitrile 2-(Cyanomethyl)thiophene 2-Thienylacetonitrile 2-Thiophen-2-ylacetonitrile 2-Thiophen-2-ylethanenitrile Thiophene-2-acetonitrile AI3-08540 EINECS 244-104-6
CAS Registry Number 20893-30-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5NS
InChI InChI=1S/C6H5NS/c7-4-3-6-2-1-5-8-6/h1-2,5H,3H2
InChIKey CLSHQIDDCJTHAJ-UHFFFAOYSA-N
Molecular Weight 123.173 g/mol
SMILES c1cc(CC#N)sc1
SPLASH splash10-00dj-9700000000-39b05eda29de9be7c400
Source of Spectrum W6-3274-0-0
Wiley ID 81063