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(2R)-2-[(2S,3S,5R)-3,5-dimethyl-6-oxidanylidene-oxan-2-yl]propanoic acid
SpectraBase Compound ID CkU7hLdikWY
InChI InChI=1S/C10H16O4/c1-5-4-6(2)10(13)14-8(5)7(3)9(11)12/h5-8H,4H2,1-3H3,(H,11,12)/t5-,6+,7+,8-/m0/s1
InChIKey BPPNRVIGLJVOCW-OSMVPFSASA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8XQtwbXkJK
Name (2R)-2-[(2S,3S,5R)-3,5-dimethyl-6-oxidanylidene-oxan-2-yl]propanoic acid
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Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-5-4-6(2)10(13)14-8(5)7(3)9(11)12/h5-8H,4H2,1-3H3,(H,11,12)/t5-,6+,7+,8-/m0/s1
InChIKey BPPNRVIGLJVOCW-OSMVPFSASA-N
Molecular Weight 200.234 g/mol
SMILES OC([C@@]([C@]1(OC([C@@](C[C@@]1(C)[H])(C)[H])=O)[H])(C)[H])=O
SPLASH splash10-0597-9010000000-6d0b8ef7844344ac6235
Source of Spectrum F-54-11579-1
Synonyms (2R)-2-[(2S,3S,5R)-3,5-dimethyl-6-oxo-2-oxanyl]propanoic acid (2R)-2-[(2S,3S,5R)-3,5-dimethyl-6-oxo-tetrahydropyran-2-yl]propanoic acid (2R)-2-[(2S,3S,5R)-3,5-dimethyl-6-oxooxan-2-yl]propanoic acid (2R)-2-[(2S,3S,5R)-6-keto-3,5-dimethyl-tetrahydropyran-2-yl]propionic acid
Wiley ID 808849