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OXYPHENYL-SINAPATE
SpectraBase Compound ID BSPR54arpa7
InChI InChI=1S/C13H16O6/c1-17-10-7-9(8-11(18-2)13(10)16)3-4-12(15)19-6-5-14/h3-4,7-8,14,16H,5-6H2,1-2H3/b4-3+
InChIKey DOYRBQFRVWNXCO-ONEGZZNKSA-N
Mol Weight 268.26 g/mol
Molecular Formula C13H16O6
Exact Mass 268.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I05Uu11NFLJ
Name 2''-Hydroxyethyl 3-[3',5'-dimethoxy-4'-hydroxyphenyl]-2-propenoate
Alternate Name(s) 2'-Hydroxyethyl 3,5-dimethoxy-4-hydroxycinnamate (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoic acid 2-hydroxyethyl ester 2-hydroxyethyl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate 2-hydroxyethyl (E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoate 2-hydroxyethyl (E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoate
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O6
InChI InChI=1S/C13H16O6/c1-17-10-7-9(8-11(18-2)13(10)16)3-4-12(15)19-6-5-14/h3-4,7-8,14,16H,5-6H2,1-2H3/b4-3+
InChIKey DOYRBQFRVWNXCO-ONEGZZNKSA-N
Molecular Weight 268.265 g/mol
SMILES OCCOC(\C=C\c1cc(c(c(c1)OC)O)OC)=O
SPLASH splash10-0aor-0090000000-061daa66491cfbc13c01
Source of Spectrum G4-70-1666-5
Wiley ID 1694802