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5-(thiophen-2-yl)pentanenitrile

View entire compound with spectra: 1 MS (GC)

5-(thiophen-2-yl)pentanenitrile
SpectraBase Compound ID 1Q7zD62A2ZP
InChI InChI=1S/C9H11NS/c10-7-3-1-2-5-9-6-4-8-11-9/h4,6,8H,1-3,5H2
InChIKey BZSMFZOCOMELQS-UHFFFAOYSA-N
Mol Weight 165.25 g/mol
Molecular Formula C9H11NS
Exact Mass 165.061221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VYHYj2iNpm
Name 5-(thiophen-2-yl)pentanenitrile
Alternate Name(s) 5-(2-Thienyl)pentanenitrile 5-Thiophen-2-ylpentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NS
InChI InChI=1S/C9H11NS/c10-7-3-1-2-5-9-6-4-8-11-9/h4,6,8H,1-3,5H2
InChIKey BZSMFZOCOMELQS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol2015972
Molecular Weight 165.254 g/mol
SMILES c1ccsc1CCCCC#N
SPLASH splash10-0002-9000000000-6fe3768158d965724254
Source of Spectrum A1-13-4084/SMS8-7c
Wiley ID 1753606