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(2S)-2-[2-[(2S,3R)-3-hydroxy-2-oxanyl]ethyl]-3-oxanone
SpectraBase Compound ID 4aaqUn0wLiC
InChI InChI=1S/C12H20O4/c13-9-3-1-7-15-11(9)5-6-12-10(14)4-2-8-16-12/h9,11-13H,1-8H2/t9-,11+,12+/m1/s1
InChIKey IBBUMFUZTIVCEW-USWWRNFRSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uZMJuuA1aw
Name (2S)-2-[2-[(2S,3R)-3-hydroxy-2-oxanyl]ethyl]-3-oxanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c13-9-3-1-7-15-11(9)5-6-12-10(14)4-2-8-16-12/h9,11-13H,1-8H2/t9-,11+,12+/m1/s1
InChIKey IBBUMFUZTIVCEW-USWWRNFRSA-N
Molecular Weight 228.288 g/mol
SMILES O[C@]1([C@](CC[C@]2(C(=O)CCCO2)[H])(OCCC1)[H])[H]
SPLASH splash10-01ot-9440000000-8dd3365a7eb6aec8f466
Source of Spectrum J-61-3010-12
Synonyms (2S)-2-[2-[(2S,3R)-3-hydroxyoxan-2-yl]ethyl]oxan-3-one (2S)-2-[2-[(2S,3R)-3-hydroxytetrahydropyran-2-yl]ethyl]tetrahydropyran-3-one (2S)-2-[2-[(2S,3R)-3-oxidanyloxan-2-yl]ethyl]oxan-3-one
Wiley ID 1229570