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(2S)-2-[(1S)-1-hydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one
SpectraBase Compound ID 8cO5swy7aXe
InChI InChI=1S/C11H18O4/c1-3-4-5-9(12)10-6-8(14-2)7-11(13)15-10/h7,9-10,12H,3-6H2,1-2H3/t9-,10-/m0/s1
InChIKey YFIMUDXPJZVJJO-UWVGGRQHSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9u2nZQWSJr1
Name (2S)-2-[(1S)-1-hydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-3-4-5-9(12)10-6-8(14-2)7-11(13)15-10/h7,9-10,12H,3-6H2,1-2H3/t9-,10-/m0/s1
InChIKey YFIMUDXPJZVJJO-UWVGGRQHSA-N
Molecular Weight 214.261 g/mol
SMILES O[C@]([C@@]1(CC(=CC(O1)=O)OC)[H])(CCCC)[H]
SPLASH splash10-014i-4920000000-de6fdb5317e736e7b92d
Source of Spectrum QC-8-3395-1
Synonyms (6S*,1'S*)-(-)-5,6-Dihydro-6-(1'-hydroxypentyl)-4-methoxypyran-2-one (-)-pestalotin (2S)-4-methoxy-2-[(1S)-1-oxidanylpentyl]-2,3-dihydropyran-6-one
Wiley ID 870201