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(2R*,4R*,5S*)-2-(4-Methoxyphenyl)-tetrahydropyran-4,5-diol
SpectraBase Compound ID CrdrGYcwByt
InChI InChI=1S/C12H16O4/c1-15-9-4-2-8(3-5-9)12-6-10(13)11(14)7-16-12/h2-5,10-14H,6-7H2,1H3/t10-,11+,12-/m1/s1
InChIKey CREAEDTWAVTKKG-GRYCIOLGSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsLx87t587h
Name (2R*,4R*,5S*)-2-(4-Methoxyphenyl)-tetrahydropyran-4,5-diol
Alternate Name(s) (5R)-1,5-anhydro-4-deoxy-5-(4-methoxyphenyl)-D-erythro-pentitol
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-15-9-4-2-8(3-5-9)12-6-10(13)11(14)7-16-12/h2-5,10-14H,6-7H2,1H3/t10-,11+,12-/m1/s1
InChIKey CREAEDTWAVTKKG-GRYCIOLGSA-N
Molecular Weight 224.256 g/mol
SMILES O[C@@]1([C@@](C[C@@](OC1)(c1ccc(cc1)OC)[H])(O)[H])[H]
SPLASH splash10-0079-0950000000-fa959adaebe593943fa6
Source of Spectrum KC-0-2634-11
Wiley ID 828933