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1H-benz[g]indole-3-carboxylic acid, 5-hydroxy-2-methyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]-, ethyl ester
SpectraBase Compound ID 3mDOczsHH24
InChI InChI=1S/C27H29NO4/c1-6-31-27(30)24-19(5)28(11-12-32-26-17(3)13-16(2)14-18(26)4)25-21-10-8-7-9-20(21)23(29)15-22(24)25/h7-10,13-15,29H,6,11-12H2,1-5H3
InChIKey GZFRUJHDPZSBJG-UHFFFAOYSA-N
Mol Weight 431.53 g/mol
Molecular Formula C27H29NO4
Exact Mass 431.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Shi3hMXk0d
Name 5-Hydroxy-2-methyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]-3-benzo[g]indolecarboxylic acid ethyl ester
Alternate Name(s) 5-Hydroxy-2-methyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]benz[g]indole-3-carboxylic acid ethyl ester Ethyl 2-methyl-5-oxidanyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]benzo[g]indole-3-carboxylate Ethyl 5-hydroxy-2-methyl-1-[2-(2,4,6-trimethylphenoxy)ethyl]benzo[g]indole-3-carboxylate
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Formula C27H29NO4
InChI InChI=1S/C27H29NO4/c1-6-31-27(30)24-19(5)28(11-12-32-26-17(3)13-16(2)14-18(26)4)25-21-10-8-7-9-20(21)23(29)15-22(24)25/h7-10,13-15,29H,6,11-12H2,1-5H3
InChIKey GZFRUJHDPZSBJG-UHFFFAOYSA-N
Molecular Weight 431.532 g/mol
SMILES Oc1c2ccccc2c2c(c(c([n]2CCOc2c(cc(cc2C)C)C)C)C(=O)OCC)c1
SPLASH splash10-00e9-3590300000-7445e3530a7ebadec2c8
Wiley ID 1461031