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(4R*,6R*)-4-Hydroxy-6-n-propyl-1-oxacyclohexan-2-one
SpectraBase Compound ID K3rJKJYhfVo
InChI InChI=1S/C8H14O3/c1-2-3-7-4-6(9)5-8(10)11-7/h6-7,9H,2-5H2,1H3/t6-,7-/m1/s1
InChIKey TWSUWPLPZNCARG-RNFRBKRXSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5oOEZCbl9n
Name (4R*,6R*)-4-Hydroxy-6-n-propyl-1-oxacyclohexan-2-one
CAS Registry Number 114431-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-2-3-7-4-6(9)5-8(10)11-7/h6-7,9H,2-5H2,1H3/t6-,7-/m1/s1
InChIKey TWSUWPLPZNCARG-RNFRBKRXSA-N
Molecular Weight 158.197 g/mol
SMILES O[C@]1(CC(O[C@](CCC)(C1)[H])=O)[H]
SPLASH splash10-00xs-9400000000-98377c3b9724118c894b
Source of Spectrum C-113-8042-2
Synonyms (4R,6R)-4-hydroxy-6-propyltetrahydro-2H-pyran-2-one (4R,6R)-4-hydroxy-6-propyl-2-oxanone (4R,6R)-4-hydroxy-6-propyloxan-2-one (4R,6R)-4-oxidanyl-6-propyl-oxan-2-one
Wiley ID 1155263