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2-(2-Formyl-5-methoxyphenyl)-6,6-dimethyl-8-phenylsulfonyloct-7-enoic acid
SpectraBase Compound ID K8Fxc4wSGIS
InChI InChI=1S/C24H28O6S/c1-24(2,14-15-31(28,29)20-8-5-4-6-9-20)13-7-10-21(23(26)27)22-16-19(30-3)12-11-18(22)17-25/h4-6,8-9,11-12,14-17,21H,7,10,13H2,1-3H3,(H,26,27)/b15-14+
InChIKey UKADLYFQHPUDIG-CCEZHUSRSA-N
Mol Weight 444.54 g/mol
Molecular Formula C24H28O6S
Exact Mass 444.16066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1pjWLvW6DY
Name 2-(2-Formyl-5-methoxyphenyl)-6,6-dimethyl-8-phenylsulfonyloct-7-enoic acid
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Formula C24H28O6S
InChI InChI=1S/C24H28O6S/c1-24(2,14-15-31(28,29)20-8-5-4-6-9-20)13-7-10-21(23(26)27)22-16-19(30-3)12-11-18(22)17-25/h4-6,8-9,11-12,14-17,21H,7,10,13H2,1-3H3,(H,26,27)/b15-14+
InChIKey UKADLYFQHPUDIG-CCEZHUSRSA-N
Molecular Weight 444.542 g/mol
SMILES OC(C(c1c(ccc(c1)OC)C=O)CCCC(\C=C\S(=O)(=O)c1ccccc1)(C)C)=O
SPLASH splash10-072l-3941000000-1e9683d6ec6bffce13b6
Source of Spectrum KC-0-1933-13
Synonyms (7E)-2-(2-formyl-5-methoxyphenyl)-6,6-dimethyl-8-(phenylsulfonyl)-7-octenoic acid (E)-8-(benzenesulfonyl)-2-(2-formyl-5-methoxyphenyl)-6,6-dimethyl-7-octenoic acid (E)-8-(benzenesulfonyl)-2-(2-formyl-5-methoxyphenyl)-6,6-dimethyloct-7-enoic acid (E)-8-(benzenesulfonyl)-2-(2-formyl-5-methoxy-phenyl)-6,6-dimethyl-oct-7-enoic acid (E)-2-(2-methanoyl-5-methoxy-phenyl)-6,6-dimethyl-8-(phenylsulfonyl)oct-7-enoic acid
Wiley ID 822829