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Methyl 6-phenyl-(5S*,6R*)-5,6-dihydroxyhexanoate

View entire compound with spectra: 1 MS (GC)

Methyl 6-phenyl-(5S*,6R*)-5,6-dihydroxyhexanoate
SpectraBase Compound ID DS16qCRCvDk
InChI InChI=1S/C13H18O4/c1-17-12(15)9-5-8-11(14)13(16)10-6-3-2-4-7-10/h2-4,6-7,11,13-14,16H,5,8-9H2,1H3/t11-,13+/m0/s1
InChIKey ULBMKCVDLYYEMO-WCQYABFASA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3S52lak2Yha
Name Methyl 6-phenyl-(5S*,6R*)-5,6-dihydroxyhexanoate
Alternate Name(s) Methyl (5S,6R)-5,6-dihydroxy-6-phenylhexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-17-12(15)9-5-8-11(14)13(16)10-6-3-2-4-7-10/h2-4,6-7,11,13-14,16H,5,8-9H2,1H3/t11-,13+/m0/s1
InChIKey ULBMKCVDLYYEMO-WCQYABFASA-N
Molecular Weight 238.283 g/mol
SMILES O[C@@]([C@](CCCC(=O)OC)(O)[H])(c1ccccc1)[H]
SPLASH splash10-052b-8900000000-5523a23e2548ada648e6
Source of Spectrum Y1-37-214-1
Wiley ID 1527334