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(2S,3R)-Ethyl 2-hydroxy-9-methyl-2-(bromodifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate
SpectraBase Compound ID 4yTWZiV3Wbp
InChI InChI=1S/C17H18BrF2NO3/c1-3-24-15(22)12-8-11-10-6-4-5-7-13(10)21(2)14(11)9-16(12,23)17(18,19)20/h4-7,12,23H,3,8-9H2,1-2H3/t12-,16-/m0/s1
InChIKey FXAXLNXETZKOLV-LRDDRELGSA-N
Mol Weight 402.24 g/mol
Molecular Formula C17H18BrF2NO3
Exact Mass 401.043813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QlhtrfLLk
Name (2S,3R)-Ethyl 2-hydroxy-9-methyl-2-(bromodifluoromethyl)-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylate
Alternate Name(s) Ethyl (2S,3R)-2-[bromo(difluoro)methyl]-2-hydroxy-9-methyl-3,4-dihydro-1H-carbazole-3-carboxylate Ethyl (2S,3R)-2-[bromanyl-bis(fluoranyl)methyl]-9-methyl-2-oxidanyl-3,4-dihydro-1H-carbazole-3-carboxylate
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Formula C17H18BrF2NO3
InChI InChI=1S/C17H18BrF2NO3/c1-3-24-15(22)12-8-11-10-6-4-5-7-13(10)21(2)14(11)9-16(12,23)17(18,19)20/h4-7,12,23H,3,8-9H2,1-2H3/t12-,16-/m0/s1
InChIKey FXAXLNXETZKOLV-LRDDRELGSA-N
Molecular Weight 402.236 g/mol
SMILES O[C@]1(Cc2c(c3ccccc3[n]2C)C[C@]1(C(=O)OCC)[H])C(F)(Br)F
SPLASH splash10-0ue9-0559300000-1913d98ae1f88f4a23f1
Source of Spectrum F-67-6336-5c
Wiley ID 1687456