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3-[2-[(5R)-5-(acetoxymethyl)-2-keto-piperidino]ethyl]indole-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID 80yPyENCtOT
InChI InChI=1S/C23H30N2O5/c1-16(26)29-15-17-9-10-21(27)24(13-17)12-11-18-14-25(22(28)30-23(2,3)4)20-8-6-5-7-19(18)20/h5-8,14,17H,9-13,15H2,1-4H3/t17-/m1/s1
InChIKey BXDLEUZXYRUJIE-QGZVFWFLSA-N
Mol Weight 414.5 g/mol
Molecular Formula C23H30N2O5
Exact Mass 414.215472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Es2vUs5Lb7t
Name 3-[2-[(5R)-5-(acetoxymethyl)-2-keto-piperidino]ethyl]indole-1-carboxylic acid tert-butyl ester
Alternate Name(s) 3-[2-[(5R)-5-(acetyloxymethyl)-2-oxo-1-piperidinyl]ethyl]-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-[2-[(5R)-5-(acetoxymethyl)-2-oxo-1-piperidyl]ethyl]indole-1-carboxylate tert-Butyl 3-[2-[(5R)-5-(acetyloxymethyl)-2-oxidanylidene-piperidin-1-yl]ethyl]indole-1-carboxylate tert-Butyl 3-[2-[(5R)-5-(acetyloxymethyl)-2-oxopiperidin-1-yl]ethyl]indole-1-carboxylate
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Formula C23H30N2O5
InChI InChI=1S/C23H30N2O5/c1-16(26)29-15-17-9-10-21(27)24(13-17)12-11-18-14-25(22(28)30-23(2,3)4)20-8-6-5-7-19(18)20/h5-8,14,17H,9-13,15H2,1-4H3/t17-/m1/s1
InChIKey BXDLEUZXYRUJIE-QGZVFWFLSA-N
Molecular Weight 414.502 g/mol
SMILES C([n]1cc(CCN2C(=O)CC[C@](C2)(COC(=O)C)[H])c2c1cccc2)(OC(C)(C)C)=O
SPLASH splash10-000l-0940100000-3fb27e6a917757d13456
Source of Spectrum QC-10-4062-14
Wiley ID 871699