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2-Pentanone, 5-(2,2,6-trimethyl-1,3-dioxan-4-yl)-, (4R-trans)-
SpectraBase Compound ID FZTYWbVcdDr
InChI InChI=1S/C12H22O3/c1-9(13)6-5-7-11-8-10(2)14-12(3,4)15-11/h10-11H,5-8H2,1-4H3/t10-,11-/m1/s1
InChIKey RHRXHOQWDGLXAU-GHMZBOCLSA-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 AS8R2lyx2w5
Name 2-Pentanone, 5-(2,2,6-trimethyl-1,3-dioxan-4-yl)-, (4R-trans)-
Alternate Name(s) (-)-(6R,8R)-6,8-(Isopropylidenedioxy)nonan-2-one 5-[(4R,6R)-2,2,6-trimethyl-1,3-dioxan-4-yl]-2-pentanone
CAS Registry Number 76331-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-9(13)6-5-7-11-8-10(2)14-12(3,4)15-11/h10-11H,5-8H2,1-4H3/t10-,11-/m1/s1
InChIKey RHRXHOQWDGLXAU-GHMZBOCLSA-N
Molecular Weight 214.305 g/mol
SMILES C1(O[C@](C)(C[C@](O1)(CCCC(=O)C)[H])[H])(C)C
SPLASH splash10-0537-9100000000-90d4eaa2fae194f326dc
Source of Spectrum H-72-1286-7
Wiley ID 1213617