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5-(2,2-DIMETHYLPROPIONYL)-7-ETHOXY-3,4,5,6-TETRAHYDRO-1H-AZEPINO-[5,4,3-CD]-INDOLE-2-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 8MTS9J9YYEa
InChI InChI=1S/C21H28N2O4/c1-6-26-16-9-8-15-17-13(18(22-15)19(24)27-7-2)10-11-23(12-14(16)17)20(25)21(3,4)5/h8-9,22H,6-7,10-12H2,1-5H3
InChIKey RPRLMGJSARBMJC-UHFFFAOYSA-N
Mol Weight 372.47 g/mol
Molecular Formula C21H28N2O4
Exact Mass 372.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Yqbr5yZWwH
Name 7-Ethoxy-5(2,2-dimethylpropionyl)-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-2-carboxylic acid ethyl ester
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Formula C21H28N2O4
InChI InChI=1S/C21H28N2O4/c1-6-26-16-9-8-15-17-13(18(22-15)19(24)27-7-2)10-11-23(12-14(16)17)20(25)21(3,4)5/h8-9,22H,6-7,10-12H2,1-5H3
InChIKey RPRLMGJSARBMJC-UHFFFAOYSA-N
Molecular Weight 372.465 g/mol
SMILES [nH]1c2ccc(c3c2c(c1C(=O)OCC)CCN(C3)C(C(C)(C)C)=O)OCC
SPLASH splash10-0a4l-7059000000-fae42b72dba930c458df
Source of Spectrum H1-45-2343-10
Synonyms Ethyl 5-(2,2-dimethylpropanoyl)-7-ethoxy-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-2-carboxylate
Wiley ID 815889