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(6RS)-N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-6-(2'-propyl)-2,3-didehydropiperidine
SpectraBase Compound ID IxGwaTqS3sS
InChI InChI=1S/C22H28N2O3/c1-5-15-13-24(19(14(2)3)11-21(15)25)20(22(26)27-4)10-16-12-23-18-9-7-6-8-17(16)18/h6-9,12-14,19-20,23H,5,10-11H2,1-4H3/t19-,20+/m1/s1
InChIKey JAIZYRBRCCQQCM-UXHICEINSA-N
Mol Weight 368.48 g/mol
Molecular Formula C22H28N2O3
Exact Mass 368.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXZjvmRuU36
Name (6RS)-N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-6-(2'-propyl)-2,3-didehydropiperidine
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Formula C22H28N2O3
InChI InChI=1S/C22H28N2O3/c1-5-15-13-24(19(14(2)3)11-21(15)25)20(22(26)27-4)10-16-12-23-18-9-7-6-8-17(16)18/h6-9,12-14,19-20,23H,5,10-11H2,1-4H3/t19-,20+/m1/s1
InChIKey JAIZYRBRCCQQCM-UXHICEINSA-N
Molecular Weight 368.477 g/mol
SMILES [nH]1c2c(c(c1)C[C@](N1C=C(CC)C(C[C@@]1(C(C)C)[H])=O)(C(=O)OC)[H])cccc2
SPLASH splash10-001i-0933000000-98c1e15d66dcdac530c6
Source of Spectrum QE-3-149-18
Synonyms (6RS)-N-((S)-1-methoxyCarbonyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-6-(2'-propyl)-2,3-didehydropiperidine (S)-2-((R)-5-Ethyl-2-isopropyl-4-oxo-3,4-dihydro-2H-pyridin-1-yl)-3-(1H-indol-3-yl)-propionic acid methyl ester
Wiley ID 843027