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1-[3-acetyl-4-(4-bromoanilino)-6-hydroxy-2-(4-isopropylphenyl)-6-methyl-cyclohex-3-en-1-yl]ethanone
SpectraBase Compound ID lb50WLEXbw
InChI InChI=1S/C26H30BrNO3/c1-15(2)18-6-8-19(9-7-18)24-23(16(3)29)22(14-26(5,31)25(24)17(4)30)28-21-12-10-20(27)11-13-21/h6-13,15,24-25,28,31H,14H2,1-5H3
InChIKey FMRGQAVMUNOEIF-UHFFFAOYSA-N
Mol Weight 484.43 g/mol
Molecular Formula C26H30BrNO3
Exact Mass 483.140907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kIF5IfQQIU
Name 1-[3-acetyl-4-(4-bromoanilino)-6-hydroxy-2-(4-isopropylphenyl)-6-methyl-cyclohex-3-en-1-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H30BrNO3
InChI InChI=1S/C26H30BrNO3/c1-15(2)18-6-8-19(9-7-18)24-23(16(3)29)22(14-26(5,31)25(24)17(4)30)28-21-12-10-20(27)11-13-21/h6-13,15,24-25,28,31H,14H2,1-5H3
InChIKey FMRGQAVMUNOEIF-UHFFFAOYSA-N
Molecular Weight 484.434 g/mol
SMILES OC1(C(C(C(=C(C1)Nc1ccc(cc1)Br)C(=O)C)c1ccc(cc1)C(C)C)C(=O)C)C
SPLASH splash10-0006-9432300000-4e75c9a23f3acca539a2
Synonyms 1-[3-acetyl-4-(4-bromoanilino)-6-hydroxy-6-methyl-2-(4-propan-2-ylphenyl)-1-cyclohex-3-enyl]ethanone 1-[3-acetyl-4-(4-bromoanilino)-6-hydroxy-6-methyl-2-(4-propan-2-ylphenyl)cyclohex-3-en-1-yl]ethanone 1-[3-acetyl-4-(4-bromoanilino)-6-hydroxy-6-methyl-2-p-cumenyl-cyclohex-3-en-1-yl]ethanone 1-[4-[(4-bromophenyl)amino]-3-ethanoyl-6-methyl-6-oxidanyl-2-(4-propan-2-ylphenyl)cyclohex-3-en-1-yl]ethanone
Wiley ID 1454680