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Methyl R-(+)-2-Formyl-2-(phenylthio)-3-(3',4',5'-trimethoxyphenyl)propanoate
SpectraBase Compound ID HjaR1sxoa9Y
InChI InChI=1S/C20H22O6S/c1-23-16-10-14(11-17(24-2)18(16)25-3)12-20(13-21,19(22)26-4)27-15-8-6-5-7-9-15/h5-11,13H,12H2,1-4H3/t20-/m1/s1
InChIKey HJOLIRJXSKKYSI-HXUWFJFHSA-N
Mol Weight 390.45 g/mol
Molecular Formula C20H22O6S
Exact Mass 390.11371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIFXlOr3VtJ
Name Methyl R-(+)-2-Formyl-2-(phenylthio)-3-(3',4',5'-trimethoxyphenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O6S
InChI InChI=1S/C20H22O6S/c1-23-16-10-14(11-17(24-2)18(16)25-3)12-20(13-21,19(22)26-4)27-15-8-6-5-7-9-15/h5-11,13H,12H2,1-4H3/t20-/m1/s1
InChIKey HJOLIRJXSKKYSI-HXUWFJFHSA-N
Molecular Weight 390.450 g/mol
SMILES [C@@](C(=O)OC)(Sc1ccccc1)(Cc1cc(OC)c(c(c1)OC)OC)C=O
SPLASH splash10-001i-0901000000-d6d686c19ded37ec8054
Source of Spectrum K-127-1716-12
Synonyms Methyl (2R)-2-formyl-2-(phenylsulfanyl)-3-(3,4,5-trimethoxyphenyl)propanoate
Wiley ID 1364703