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1-(2-Thienyl)hexane-1,3,5-trione

View entire compound with spectra: 1 MS (GC)

1-(2-Thienyl)hexane-1,3,5-trione
SpectraBase Compound ID JpdK3PJemti
InChI InChI=1S/C10H10O3S/c1-7(11)5-8(12)6-9(13)10-3-2-4-14-10/h2-4H,5-6H2,1H3
InChIKey DNNXEIYTZSGRCE-UHFFFAOYSA-N
Mol Weight 210.25 g/mol
Molecular Formula C10H10O3S
Exact Mass 210.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gDAQpYDlHq
Name 1-(2-Thienyl)hexane-1,3,5-trione
Alternate Name(s) 1-(2-Thienyl)-1,3,5-hexanetrione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O3S
InChI InChI=1S/C10H10O3S/c1-7(11)5-8(12)6-9(13)10-3-2-4-14-10/h2-4H,5-6H2,1H3
InChIKey DNNXEIYTZSGRCE-UHFFFAOYSA-N
Molecular Weight 210.247 g/mol
SMILES C(CC(CC(C)=O)=O)(=O)c1cccs1
SPLASH splash10-03dl-3910000000-80f034e767d9b7d7c0c3
Source of Spectrum Y1-39-193-3
Wiley ID 1527952