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1-Acetyl-5-bromo-3-methoxycarbonylmethylindole
SpectraBase Compound ID 9jMNisYPJxY
InChI InChI=1S/C13H12BrNO3/c1-8(16)15-7-9(5-13(17)18-2)11-6-10(14)3-4-12(11)15/h3-4,6-7H,5H2,1-2H3
InChIKey ZZOCXLHSUQEMSJ-UHFFFAOYSA-N
Mol Weight 310.15 g/mol
Molecular Formula C13H12BrNO3
Exact Mass 309.000056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iboh7fe8Lnu
Name 1-Acetyl-5-bromo-3-methoxycarbonylmethylindole
Alternate Name(s) Methyl (1-acetyl-5-bromo-1H-indol-3-yl)acetate
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Formula C13H12BrNO3
InChI InChI=1S/C13H12BrNO3/c1-8(16)15-7-9(5-13(17)18-2)11-6-10(14)3-4-12(11)15/h3-4,6-7H,5H2,1-2H3
InChIKey ZZOCXLHSUQEMSJ-UHFFFAOYSA-N
Molecular Weight 310.147 g/mol
SMILES c1[n](c2ccc(cc2c1CC(=O)OC)Br)C(=O)C
SPLASH splash10-0cdi-0093000000-d389bde4d457af82611f
Source of Spectrum SO-0-701-4
Wiley ID 1542338