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(E)-2-(4-Nitrobut-3-en-1-yn-1-yl)thiophene

View entire compound with spectra: 1 MS (GC)

(E)-2-(4-Nitrobut-3-en-1-yn-1-yl)thiophene
SpectraBase Compound ID 9bZ0X4EBN9U
InChI InChI=1S/C8H5NO2S/c10-9(11)6-2-1-4-8-5-3-7-12-8/h2-3,5-7H/b6-2+
InChIKey RJFFNZQBPRKPNO-QHHAFSJGSA-N
Mol Weight 179.19 g/mol
Molecular Formula C8H5NO2S
Exact Mass 179.0041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID If8MjZpFb6R
Name (E)-2-(4-Nitrobut-3-en-1-yn-1-yl)thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5NO2S
InChI InChI=1S/C8H5NO2S/c10-9(11)6-2-1-4-8-5-3-7-12-8/h2-3,5-7H/b6-2+
InChIKey RJFFNZQBPRKPNO-QHHAFSJGSA-N
Literature Reference DOI 10.1039/C4CC09495F
Molecular Weight 179.193 g/mol
SMILES c1(C#C\C=C\[N+]([O-])=O)sccc1
SPLASH splash10-01sr-4900000000-6b296a7a74ed5b3b7155
Source of Spectrum KD-51-2266/SM9-1k
Wiley ID 1800828