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(7R)-7-(4-fluorophenyl)-7-(6-hydroxy-4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)heptanoic acid methyl ester
SpectraBase Compound ID LKWQeKLNcvy
InChI InChI=1S/C25H31FO3/c1-16-20-9-7-10-21(20)17(2)25(28)24(16)22(18-12-14-19(26)15-13-18)8-5-4-6-11-23(27)29-3/h12-15,22,28H,4-11H2,1-3H3/t22-/m1/s1
InChIKey PEIIIWUGMWQGFE-JOCHJYFZSA-N
Mol Weight 398.52 g/mol
Molecular Formula C25H31FO3
Exact Mass 398.225723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ExMTVaG7IH
Name (7R)-7-(4-fluorophenyl)-7-(6-hydroxy-4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)heptanoic acid methyl ester
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Formula C25H31FO3
InChI InChI=1S/C25H31FO3/c1-16-20-9-7-10-21(20)17(2)25(28)24(16)22(18-12-14-19(26)15-13-18)8-5-4-6-11-23(27)29-3/h12-15,22,28H,4-11H2,1-3H3/t22-/m1/s1
InChIKey PEIIIWUGMWQGFE-JOCHJYFZSA-N
Molecular Weight 398.518 g/mol
SMILES Oc1c([C@](CCCCCC(=O)OC)(c2ccc(cc2)F)[H])c(c2CCCc2c1C)C
SPLASH splash10-014i-0094000000-8035fca746ebcf370f7d
Source of Spectrum E1-44-753-8
Synonyms (7R)-7-(4-fluorophenyl)-7-(6-hydroxy-4,7-dimethyl-indan-5-yl)enanthic acid methyl ester Methyl (7R)-7-(4,7-dimethyl-6-oxidanyl-2,3-dihydro-1H-inden-5-yl)-7-(4-fluorophenyl)heptanoate Methyl (7R)-7-(4-fluorophenyl)-7-(6-hydroxy-4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)heptanoate Methyl (7R)-7-(4-fluorophenyl)-7-(6-hydroxy-4,7-dimethyl-indan-5-yl)heptanoate
Wiley ID 1553376