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1,2,3-Propanetriol, 1-(2-methoxyphenyl)-, triacetate, (R*,S*)-
SpectraBase Compound ID 8PPXFL9BgKg
InChI InChI=1S/C16H20O7/c1-10(17)21-9-15(22-11(2)18)16(23-12(3)19)13-7-5-6-8-14(13)20-4/h5-8,15-16H,9H2,1-4H3/t15-,16+/m1/s1
InChIKey OHAVMJZNBOSIIG-CVEARBPZSA-N
Mol Weight 324.33 g/mol
Molecular Formula C16H20O7
Exact Mass 324.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lCs2s0Mpdc
Name 1,2,3-Propanetriol, 1-(2-methoxyphenyl)-, triacetate, (R*,S*)-
CAS Registry Number 86659-54-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O7
InChI InChI=1S/C16H20O7/c1-10(17)21-9-15(22-11(2)18)16(23-12(3)19)13-7-5-6-8-14(13)20-4/h5-8,15-16H,9H2,1-4H3/t15-,16+/m1/s1
InChIKey OHAVMJZNBOSIIG-CVEARBPZSA-N
Molecular Weight 324.329 g/mol
SMILES [C@@](c1c(OC)cccc1)([C@](OC(=O)C)(COC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-000f-6900000000-312fc9d3b5bcd38c98f9
Source of Spectrum KC-1983-895-0
Synonyms (1R,2S)-2-(acetyloxy)-1-[(acetyloxy)methyl]-2-(2-methoxyphenyl)ethyl acetate Threo-3-(2-methoxyphenyl)propane-1,2,3-triyl triacetate
Wiley ID 1323027