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5-Butyl-4-(hex-1-yn-1-yl)-7H-thieno[2,3-c]pyran-7-one
SpectraBase Compound ID DMijyS9CI9a
InChI InChI=1S/C17H20O2S/c1-3-5-7-8-9-13-14-11-12-20-16(14)17(18)19-15(13)10-6-4-2/h11-12H,3-7,10H2,1-2H3
InChIKey MWNWENNYLQPKKC-UHFFFAOYSA-N
Mol Weight 288.4 g/mol
Molecular Formula C17H20O2S
Exact Mass 288.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOjUHplFpaO
Name 5-Butyl-4-(hex-1-yn-1-yl)-7H-thieno[2,3-c]pyran-7-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O2S
InChI InChI=1S/C17H20O2S/c1-3-5-7-8-9-13-14-11-12-20-16(14)17(18)19-15(13)10-6-4-2/h11-12H,3-7,10H2,1-2H3
InChIKey MWNWENNYLQPKKC-UHFFFAOYSA-N
Instrument Name GC??MS apparatus
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000468
Molecular Weight 288.405 g/mol
SMILES C(CCC)C1=C(c2c(C(O1)=O)scc2)C#CCCCC
SPLASH splash10-000j-0290000000-a69cbad30a0393cfca84
Source of Spectrum U1-2020-3724-12
Wiley ID 1860724