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Methyl 7-bromo-2-methyl-1H-indole-6-carboxylate
SpectraBase Compound ID 8N0vj2XGtxa
InChI InChI=1S/C11H10BrNO2/c1-6-5-7-3-4-8(11(14)15-2)9(12)10(7)13-6/h3-5,13H,1-2H3
InChIKey WVHVTGWWBNQMCJ-UHFFFAOYSA-N
Mol Weight 268.11 g/mol
Molecular Formula C11H10BrNO2
Exact Mass 266.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUvnf9otxPT
Name Methyl 7-bromo-2-methyl-1H-indole-6-carboxylate
Appearance Pale yellow solid
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Formula C11H10BrNO2
InChI InChI=1S/C11H10BrNO2/c1-6-5-7-3-4-8(11(14)15-2)9(12)10(7)13-6/h3-5,13H,1-2H3
InChIKey WVHVTGWWBNQMCJ-UHFFFAOYSA-N
Instrument Name Kratos MS 50/Thermo Quest Finnigan MAT 95 XL
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.132
Molecular Weight 268.110 g/mol
Reported Formula C11H10BrNO2
SMILES [nH]1c(cc2ccc(c(c12)Br)C(OC)=O)C
SPLASH splash10-014r-0190000000-482ed55cb8da23274ab2
Source of Spectrum BJO-8-SM15-4{d,c}
Thin-Layer Chromatography Rf = 0.47 (cyclohexane/ethyl acetate, 3:1)
Wiley ID 1864918