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(E)-1-Cyclohexyl-2-hydroxymethyl-2-buten-1-one
SpectraBase Compound ID 2aZ9alhFHUg
InChI InChI=1S/C11H18O2/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h2,10,12H,3-8H2,1H3/b9-2+
InChIKey JPDRKGBUGYMREK-XNWCZRBMSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4ZayWASTTA
Name (E)-1-Cyclohexyl-2-hydroxymethyl-2-buten-1-one
CAS Registry Number 143447-27-2
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-2-9(8-12)11(13)10-6-4-3-5-7-10/h2,10,12H,3-8H2,1H3/b9-2+
InChIKey JPDRKGBUGYMREK-XNWCZRBMSA-N
Molecular Weight 182.263 g/mol
SMILES OC\C(C(=O)C1CCCCC1)=C/C
SPLASH splash10-0002-9400000000-c6aa1d4133048c609fb9
Source of Spectrum K-126-300-5
Synonyms (2E)-1-cyclohexyl-2-(hydroxymethyl)-2-buten-1-one
Wiley ID 1178882