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2-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]-2-methyl-3-pentanone
SpectraBase Compound ID 4tatJNSBNm4
InChI InChI=1S/C12H22O3/c1-6-9(13)11(2,3)10-7-8-14-12(4,5)15-10/h10H,6-8H2,1-5H3/t10-/m0/s1
InChIKey QGPKAFNRXHKSMT-JTQLQIEISA-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 8F2AGGPcIQd
Name 2-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]-2-methyl-3-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-6-9(13)11(2,3)10-7-8-14-12(4,5)15-10/h10H,6-8H2,1-5H3/t10-/m0/s1
InChIKey QGPKAFNRXHKSMT-JTQLQIEISA-N
Molecular Weight 214.305 g/mol
SMILES C([C@]1(OC(C)(C)OCC1)[H])(C(=O)CC)(C)C
SPLASH splash10-0a4i-9500000000-72f62c4731574e78fe78
Source of Spectrum QE-2-1479-3
Synonyms 2-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]-2-methyl-pentan-3-one
Wiley ID 842847