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trans-2-(1-methylethyl)-1,7-dioxaspiro[5.5]undecane-3-one
SpectraBase Compound ID 6MNXHiKlYNS
InChI InChI=1S/C12H20O3/c1-9(2)11-10(13)5-7-12(15-11)6-3-4-8-14-12/h9,11H,3-8H2,1-2H3/t11-,12+/m1/s1
InChIKey POWRIWDXSDITBU-NEPJUHHUSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyaQMcZ5bcx
Name trans-2-(1-methylethyl)-1,7-dioxaspiro[5.5]undecane-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-9(2)11-10(13)5-7-12(15-11)6-3-4-8-14-12/h9,11H,3-8H2,1-2H3/t11-,12+/m1/s1
InChIKey POWRIWDXSDITBU-NEPJUHHUSA-N
Molecular Weight 212.289 g/mol
SMILES [C@@]12(O[C@@](C(CC2)=O)(C(C)C)[H])OCCCC1
SPLASH splash10-03di-4900000000-d1eac3709f19422dca13
Source of Spectrum C-110-1907-20
Synonyms (2R,6S)-2-isopropyl-1,7-dioxaspiro[5.5]undecan-3-one
Wiley ID 1211494