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Methyl 7-vinyl-1H-indole-6-carboxylate
SpectraBase Compound ID CxlBgQK7X3X
InChI InChI=1S/C12H11NO2/c1-3-9-10(12(14)15-2)5-4-8-6-7-13-11(8)9/h3-7,13H,1H2,2H3
InChIKey DBEKOLJMRNLFKQ-UHFFFAOYSA-N
Mol Weight 201.22 g/mol
Molecular Formula C12H11NO2
Exact Mass 201.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0nhIIqYPvw
Name Methyl 7-vinyl-1H-indole-6-carboxylate
Appearance Pale yellow solid
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Formula C12H11NO2
InChI InChI=1S/C12H11NO2/c1-3-9-10(12(14)15-2)5-4-8-6-7-13-11(8)9/h3-7,13H,1H2,2H3
InChIKey DBEKOLJMRNLFKQ-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 201.225 g/mol
Reported Formula C12H11NO2
SMILES [nH]1ccc2c1c(c(cc2)C(OC)=O)C=C
SPLASH splash10-0uk9-0890000000-44865c6fe7015e1589b8
Source of Spectrum BJO-8-SM21-4{m,a}
Thin-Layer Chromatography Rf = 0.38 (cyclohexane/ethyl acetate, 3:1)
Wiley ID 1864928