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1,2-Propanediol, 1-(2-methoxyphenyl)-3-phenyl-, diacetate, (R*,S*)-
SpectraBase Compound ID DgmjTbyeCFx
InChI InChI=1S/C20H22O5/c1-14(21)24-19(13-16-9-5-4-6-10-16)20(25-15(2)22)17-11-7-8-12-18(17)23-3/h4-12,19-20H,13H2,1-3H3/t19-,20+/m0/s1
InChIKey UXUHSVNVQMSKOG-VQTJNVASSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Z8sY9EEaan
Name 1,2-Propanediol, 1-(2-methoxyphenyl)-3-phenyl-, diacetate, (R*,S*)-
Alternate Name(s) (1S,2R)-2-(acetyloxy)-1-benzyl-2-(2-methoxyphenyl)ethyl acetate Erythro-1,2-diacetoxy-1-(2'-methoxyphenyl)-3-phenylpropane
CAS Registry Number 130542-69-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-14(21)24-19(13-16-9-5-4-6-10-16)20(25-15(2)22)17-11-7-8-12-18(17)23-3/h4-12,19-20H,13H2,1-3H3/t19-,20+/m0/s1
InChIKey UXUHSVNVQMSKOG-VQTJNVASSA-N
Molecular Weight 342.391 g/mol
SMILES [C@](c1c(OC)cccc1)([C@@](OC(=O)C)(Cc1ccccc1)[H])(OC(=O)C)[H]
SPLASH splash10-000l-5920000000-e026e59b2fd3f4e1459c
Source of Spectrum B-43-1333-9
Wiley ID 1336664