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Ethyl 2-(5-chloro-1-methylindol-3-yl)acetate
SpectraBase Compound ID J7ZHrJ76120
InChI InChI=1S/C13H14ClNO2/c1-3-17-13(16)6-9-8-15(2)12-5-4-10(14)7-11(9)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey OIKUIMSMKROWGX-UHFFFAOYSA-N
Mol Weight 251.71 g/mol
Molecular Formula C13H14ClNO2
Exact Mass 251.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KkqFjXzynv
Name Ethyl 2-(5-chloro-1-methylindol-3-yl)acetate
Appearance Yellow oil
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Exact Mass 251.071306393 u
Formula C13H14ClNO2
GC Oven Program Oven temp 280oC
InChI InChI=1S/C13H14ClNO2/c1-3-17-13(16)6-9-8-15(2)12-5-4-10(14)7-11(9)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey OIKUIMSMKROWGX-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804779
Molecular Weight 251.713 g/mol
SMILES C(C)OC(CC1=CN(C2=C1C=C(C=C2)Cl)C)=O
SPLASH splash10-004i-0900000000-6946df315afbdec471c3
Source of Spectrum ACI-57-SM20-13b (DOI: 10.1002/anie.201804779)
Wiley ID 1893169