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Erythro-(E)-3,4-epoxy-5-isopropyl-nonane-2,8-dione
SpectraBase Compound ID HjoKYXg9pgz
InChI InChI=1S/C12H22O3/c1-7(2)10(6-5-8(3)13)12-11(15-12)9(4)14/h7,9-12,14H,5-6H2,1-4H3/t9?,10-,11-,12+/m0/s1
InChIKey SBFHSJLYXLJOQP-HSTDOPHLSA-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 OyYiO0NVa0
Name Erythro-(E)-3,4-epoxy-5-isopropyl-nonane-2,8-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-7(2)10(6-5-8(3)13)12-11(15-12)9(4)14/h7,9-12,14H,5-6H2,1-4H3/t9?,10-,11-,12+/m0/s1
InChIKey SBFHSJLYXLJOQP-HSTDOPHLSA-N
Literature Reference DOI 10.1002/hlca.19750580702
Molecular Weight 214.305 g/mol
SMILES OC([C@]1([C@@]([C@@](CCC(C)=O)(C(C)C)[H])(O1)[H])[H])C
SPLASH splash10-0006-9100000000-c4c4e2102507d51b502f
Source of Spectrum H-58-1876-A2
Synonyms (5S)-5-((2R,3S)-3-(1-hydroxyethyl)oxiran-2-yl)-6-methylheptan-2-one
Wiley ID 1799913