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1H-benz[g]indole-3-carboxylic acid, 1-[[4-(1,1-dimethylethyl)phenyl]methyl]-5-hydroxy-2-methyl-, methyl ester
SpectraBase Compound ID FJMDGKEZXvd
InChI InChI=1S/C26H27NO3/c1-16-23(25(29)30-5)21-14-22(28)19-8-6-7-9-20(19)24(21)27(16)15-17-10-12-18(13-11-17)26(2,3)4/h6-14,28H,15H2,1-5H3
InChIKey KPSSTTVIDKBBRU-UHFFFAOYSA-N
Mol Weight 401.51 g/mol
Molecular Formula C26H27NO3
Exact Mass 401.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjdRO7hjDzv
Name 1-(4-tert-butylbenzyl)-5-hydroxy-2-methyl-benz[g]indole-3-carboxylic acid methyl ester
Alternate Name(s) 1-[(4-tert-butylphenyl)methyl]-5-hydroxy-2-methyl-3-benzo[g]indolecarboxylic acid methyl ester Methyl 1-(4-tert-butylbenzyl)-5-hydroxy-2-methyl-1H-benzo[g]indole-3-carboxylate Methyl 1-[(4-tert-butylphenyl)methyl]-2-methyl-5-oxidanyl-benzo[g]indole-3-carboxylate Methyl 1-[(4-tert-butylphenyl)methyl]-5-hydroxy-2-methyl-benzo[g]indole-3-carboxylate
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Formula C26H27NO3
InChI InChI=1S/C26H27NO3/c1-16-23(25(29)30-5)21-14-22(28)19-8-6-7-9-20(19)24(21)27(16)15-17-10-12-18(13-11-17)26(2,3)4/h6-14,28H,15H2,1-5H3
InChIKey KPSSTTVIDKBBRU-UHFFFAOYSA-N
Molecular Weight 401.506 g/mol
SMILES Oc1c2ccccc2c2c(c(c([n]2Cc2ccc(C(C)(C)C)cc2)C)C(=O)OC)c1
SPLASH splash10-0f6t-3900200000-8bbeb8cd6553a6e2457c
Wiley ID 1463495