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2,2-Bis(3-hydroxy-5-methylbenzyl)-7-methylindan-1-one
SpectraBase Compound ID BD63FUxpovj
InChI InChI=1S/C26H26O3/c1-16-7-19(11-22(27)9-16)13-26(14-20-8-17(2)10-23(28)12-20)15-21-6-4-5-18(3)24(21)25(26)29/h4-12,27-28H,13-15H2,1-3H3
InChIKey BCYSMKOLRYJHPH-UHFFFAOYSA-N
Mol Weight 386.49 g/mol
Molecular Formula C26H26O3
Exact Mass 386.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNMls3WJmyR
Name 2,2-Bis(3-hydroxy-5-methylbenzyl)-7-methylindan-1-one
Alternate Name(s) 2,2-Bis(3-hydroxy-5-methylbenzyl)-7-methyl-1-indanone 2,2-bis[(3-hydroxy-5-methyl-phenyl)methyl]-7-methyl-indan-1-one 2,2-bis[(3-hydroxy-5-methylphenyl)methyl]-7-methyl-3H-inden-1-one 7-Methyl-2,2-bis[(3-methyl-5-oxidanyl-phenyl)methyl]-3H-inden-1-one
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Formula C26H26O3
InChI InChI=1S/C26H26O3/c1-16-7-19(11-22(27)9-16)13-26(14-20-8-17(2)10-23(28)12-20)15-21-6-4-5-18(3)24(21)25(26)29/h4-12,27-28H,13-15H2,1-3H3
InChIKey BCYSMKOLRYJHPH-UHFFFAOYSA-N
Molecular Weight 386.491 g/mol
SMILES Oc1cc(CC2(Cc3cc(cc(c3)O)C)C(c3c(cccc3C)C2)=O)cc(c1)C
SPLASH splash10-01b9-0891000000-85a3902d66ddd101b685
Wiley ID 1477138