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2,2,2-trichloro-1,1-dimethylethyl 1-(Carbomethoxymethyl)-5-methoxy-1,2-dihydrobenz[e]indole-3-carboxylate
SpectraBase Compound ID AzFZ4KmoGqk
InChI InChI=1S/C21H22Cl3NO5/c1-20(2,21(22,23)24)30-19(27)25-11-12(9-17(26)29-4)18-14-8-6-5-7-13(14)16(28-3)10-15(18)25/h5-8,10,12H,9,11H2,1-4H3
InChIKey FHDDEWRCUVHBEW-UHFFFAOYSA-N
Mol Weight 474.77 g/mol
Molecular Formula C21H22Cl3NO5
Exact Mass 473.056356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HslvUwL5QBo
Name 2,2,2-trichloro-1,1-dimethylethyl 1-(Carbomethoxymethyl)-5-methoxy-1,2-dihydrobenz[e]indole-3-carboxylate
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Formula C21H22Cl3NO5
InChI InChI=1S/C21H22Cl3NO5/c1-20(2,21(22,23)24)30-19(27)25-11-12(9-17(26)29-4)18-14-8-6-5-7-13(14)16(28-3)10-15(18)25/h5-8,10,12H,9,11H2,1-4H3
InChIKey FHDDEWRCUVHBEW-UHFFFAOYSA-N
Molecular Weight 474.768 g/mol
SMILES c12N(CC(c2c2ccccc2c(c1)OC)CC(=O)OC)C(OC(C(Cl)(Cl)Cl)(C)C)=O
SPLASH splash10-00dj-2950300000-bee594abfbb88d6684d6
Source of Spectrum J-56-2244-21
Synonyms 2,2,2-trichloro-1,1-dimethylethyl 5-methoxy-1-(2-methoxy-2-oxoethyl)-1,2-dihydro-3H-benzo[e]indole-3-carboxylate
Wiley ID 1393610