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trans-2-Methyl-1-(4-hydroxybut-2-yl)cyclopentan-3-one ketal
SpectraBase Compound ID FRH2hChuprb
InChI InChI=1S/C12H22O3/c1-9(4-6-13)11-3-5-12(10(11)2)14-7-8-15-12/h9-11,13H,3-8H2,1-2H3/t9?,10-,11-/m0/s1
InChIKey ODDIRDOOQVFBFK-DVRYWGNFSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ca643fIAGfk
Name trans-2-Methyl-1-(4-hydroxybut-2-yl)cyclopentan-3-one ketal
Comments Less than 3 mono-isotopic peaks
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Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-9(4-6-13)11-3-5-12(10(11)2)14-7-8-15-12/h9-11,13H,3-8H2,1-2H3/t9?,10-,11-/m0/s1
InChIKey ODDIRDOOQVFBFK-DVRYWGNFSA-N
Molecular Weight 214.305 g/mol
SMILES OCCC([C@]1([C@@](C2(OCCO2)CC1)(C)[H])[H])C
SPLASH splash10-0002-9000000000-775d3b6bea6d1a96c63c
Source of Spectrum J-63-2330-0
Synonyms 3-[(6S,7S)-6-methyl-1,4-dioxaspiro[4.4]non-7-yl]-1-butanol
Wiley ID 1213663