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2-cyclohexen-1-one 1,4-di-o-methyl-l-threitol ketal
SpectraBase Compound ID 9AgtEcABHJF
InChI InChI=1S/C12H20O4/c1-13-8-10-11(9-14-2)16-12(15-10)6-4-3-5-7-12/h4,6,10-11H,3,5,7-9H2,1-2H3
InChIKey JVKRZHMBTHVPNI-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9vGmT9qWrd
Name 2-cyclohexen-1-one 1,4-di-o-methyl-l-threitol ketal
Alternate Name(s) 2,3-bis(methoxymethyl)-1,4-dioxaspiro[4.5]dec-6-ene
CAS Registry Number 111970-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-13-8-10-11(9-14-2)16-12(15-10)6-4-3-5-7-12/h4,6,10-11H,3,5,7-9H2,1-2H3
InChIKey JVKRZHMBTHVPNI-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES C12(OC(COC)C(O2)COC)C=CCCC1
SPLASH splash10-0ldi-9220000000-51077b59b55d929afae3
Source of Spectrum J-55-2049-2
Wiley ID 1229544