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5-Benzyl-3-methyl-5-(ethylthio)-2(5H)-furanone
SpectraBase Compound ID LuIAa3b8tzg
InChI InChI=1S/C14H16O2S/c1-3-17-14(9-11(2)13(15)16-14)10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3
InChIKey CKQAHLYUIXZIST-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C14H16O2S
Exact Mass 248.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID p5ayI0y0Se
Name 5-Benzyl-3-methyl-5-(ethylthio)-2(5H)-furanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2S
InChI InChI=1S/C14H16O2S/c1-3-17-14(9-11(2)13(15)16-14)10-12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3
InChIKey CKQAHLYUIXZIST-UHFFFAOYSA-N
Molecular Weight 248.340 g/mol
SMILES C1(OC(=O)C(=C1)C)(Cc1ccccc1)SCC
SPLASH splash10-0a4i-0900000000-1261ccad3c3fff46f8f2
Source of Spectrum Y4-91-81-20
Synonyms 5-benzyl-5-(ethylsulfanyl)-3-methyl-2(5H)-furanone
Wiley ID 1550461