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(2R,3S)-cis-4'-Methoxy-3-O-acetylflavan
SpectraBase Compound ID APHvqPYevMB
InChI InChI=1S/C18H18O4/c1-12(19)21-17-11-14-5-3-4-6-16(14)22-18(17)13-7-9-15(20-2)10-8-13/h3-10,17-18H,11H2,1-2H3/t17-,18-/m0/s1
InChIKey AJTHQFDFQAZPKC-ROUUACIJSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A47HkEk8uHC
Name (2R,3S)-cis-4'-Methoxy-3-O-acetylflavan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-12(19)21-17-11-14-5-3-4-6-16(14)22-18(17)13-7-9-15(20-2)10-8-13/h3-10,17-18H,11H2,1-2H3/t17-,18-/m0/s1
InChIKey AJTHQFDFQAZPKC-ROUUACIJSA-N
Molecular Weight 298.338 g/mol
SMILES [C@@]1(Oc2c(C[C@@]1(OC(=O)C)[H])cccc2)(c1ccc(cc1)OC)[H]
SPLASH splash10-0fki-0930000000-a106bbe36ac41f5f1c45
Source of Spectrum KC-0-3419-26
Synonyms Acetic acid [(2S,3S)-2-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester [(2S,3S)-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] acetate [(2S,3S)-2-(4-methoxyphenyl)chroman-3-yl] acetate [(2S,3S)-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] ethanoate
Wiley ID 823938