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3-(Non-2'-enylthio)pentane-2,4-dione
SpectraBase Compound ID A62lIQ3HtDB
InChI InChI=1S/C14H24O2S/c1-4-5-6-7-8-9-10-11-17-14(12(2)15)13(3)16/h9-10,14H,4-8,11H2,1-3H3/b10-9+
InChIKey QGRQHITUPJQCDK-MDZDMXLPSA-N
Mol Weight 256.4 g/mol
Molecular Formula C14H24O2S
Exact Mass 256.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yEglXzJpg8
Name 3-(Non-2'-enylthio)pentane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2S
InChI InChI=1S/C14H24O2S/c1-4-5-6-7-8-9-10-11-17-14(12(2)15)13(3)16/h9-10,14H,4-8,11H2,1-3H3/b10-9+
InChIKey QGRQHITUPJQCDK-MDZDMXLPSA-N
Molecular Weight 256.404 g/mol
SMILES C(C(=O)C)(C(=O)C)SC\C=C\CCCCCC
SPLASH splash10-0159-9700000000-fd563951e24901144b5c
Source of Spectrum U1-1999-3377-6
Synonyms 3-[(2E)-2-nonenylsulfanyl]-2,4-pentanedione
Wiley ID 753488