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3-[3'-(2"-Hydroxyphenyl)prop-2'-enylthio]pentane-2,4-dione
SpectraBase Compound ID 2eKbD6Y6ilV
InChI InChI=1S/C14H16O3S/c1-10(15)14(11(2)16)18-9-5-7-12-6-3-4-8-13(12)17/h3-8,14,17H,9H2,1-2H3/b7-5+
InChIKey TZBNLIDESCILCG-FNORWQNLSA-N
Mol Weight 264.34 g/mol
Molecular Formula C14H16O3S
Exact Mass 264.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KLnLDHlgriP
Name 3-[3'-(2"-Hydroxyphenyl)prop-2'-enylthio]pentane-2,4-dione
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Formula C14H16O3S
InChI InChI=1S/C14H16O3S/c1-10(15)14(11(2)16)18-9-5-7-12-6-3-4-8-13(12)17/h3-8,14,17H,9H2,1-2H3/b7-5+
InChIKey TZBNLIDESCILCG-FNORWQNLSA-N
Molecular Weight 264.339 g/mol
SMILES Oc1c(\C=C\CSC(C(=O)C)C(=O)C)cccc1
SPLASH splash10-01q9-0950000000-96c7c8f7732c050c190c
Source of Spectrum U1-1999-3378-6
Synonyms 3-{[(2E)-3-(2-hydroxyphenyl)-2-propenyl]sulfanyl}-2,4-pentanedione
Wiley ID 753486