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Methyl 5-chloro-3-(dimethylamino)-1H-indole-2-carboxylate
SpectraBase Compound ID KcDT6EJtvtD
InChI InChI=1S/C12H13ClN2O2/c1-15(2)11-8-6-7(13)4-5-9(8)14-10(11)12(16)17-3/h4-6,14H,1-3H3
InChIKey KRQCZQFOWSGIFR-UHFFFAOYSA-N
Mol Weight 252.7 g/mol
Molecular Formula C12H13ClN2O2
Exact Mass 252.066555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41kv6WQzM8
Name Methyl 5-chloro-3-(dimethylamino)-1H-indole-2-carboxylate
Appearance Brown-redish solid
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Formula C12H13ClN2O2
InChI InChI=1S/C12H13ClN2O2/c1-15(2)11-8-6-7(13)4-5-9(8)14-10(11)12(16)17-3/h4-6,14H,1-3H3
InChIKey KRQCZQFOWSGIFR-UHFFFAOYSA-N
Instrument Name Thermo-Finnigan Polaris Q and Jeol JSM-GCMateII
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.138
Molecular Weight 252.701 g/mol
Reported Formula C12H13ClN2O2
SMILES [nH]1c2c(c(c1C(OC)=O)N(C)C)cc(cc2)Cl
SPLASH splash10-0ufu-0950000000-1fe9b589e12dd5539e76
Source of Spectrum ARK-2014-44-2e
Thin-Layer Chromatography Rf = 0.58 (hexane/EtOAc, 7:3)
Wiley ID 1843237