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1-[(2R)-1,4-Dioxa[4.5]dec-2-yl]pentanone
SpectraBase Compound ID E75IpfPOY5a
InChI InChI=1S/C13H22O3/c1-2-3-7-11(14)12-10-15-13(16-12)8-5-4-6-9-13/h12H,2-10H2,1H3/t12-/m1/s1
InChIKey LDBWTULWAFSVAI-GFCCVEGCSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CuXrPWYp7id
Name 1-[(2R)-1,4-Dioxa[4.5]dec-2-yl]pentanone
Alternate Name(s) (R)-1-(1,4-dioxaspiro[4.5]decan-2-yl)pentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-2-3-7-11(14)12-10-15-13(16-12)8-5-4-6-9-13/h12H,2-10H2,1H3/t12-/m1/s1
InChIKey LDBWTULWAFSVAI-GFCCVEGCSA-N
Literature Reference DOI 10.1002/prac.19913330610
Molecular Weight 226.316 g/mol
SMILES C12(O[C@](C(=O)CCCC)([H])CO2)CCCCC1
SPLASH splash10-0a4l-9720000000-0306eb702b410487b56a
Source of Spectrum JF-333-884-4d
Wiley ID 1789692