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methyl 2-(2-chlorophenyl)-2-(5-methylindol-1-yl)acetate
SpectraBase Compound ID Iw67dSEjzlx
InChI InChI=1S/C18H16ClNO2/c1-12-7-8-16-13(11-12)9-10-20(16)17(18(21)22-2)14-5-3-4-6-15(14)19/h3-11,17H,1-2H3
InChIKey OVVDCKUOOIVEBX-UHFFFAOYSA-N
Mol Weight 313.78 g/mol
Molecular Formula C18H16ClNO2
Exact Mass 313.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Du2jqqo8b0
Name methyl 2-(2-chlorophenyl)-2-(5-methylindol-1-yl)acetate
Appearance White solid
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Formula C18H16ClNO2
InChI InChI=1S/C18H16ClNO2/c1-12-7-8-16-13(11-12)9-10-20(16)17(18(21)22-2)14-5-3-4-6-15(14)19/h3-11,17H,1-2H3
InChIKey OVVDCKUOOIVEBX-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 or Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910864
Molecular Weight 313.784 g/mol
Reported Formula C18H16NO2(35)Cl
SMILES c1(Cl)ccccc1C(C(=O)OC)[n]1ccc2c1ccc(c2)C
SPLASH splash10-0zfr-0092000000-0baf85411e69113aa905
Source of Spectrum ACI-59-SM21-8j
Wiley ID 1856865