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N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-2,3-didehydropiperidine
SpectraBase Compound ID 2T0CxZXmuBN
InChI InChI=1S/C19H22N2O3/c1-3-13-12-21(9-8-18(13)22)17(19(23)24-2)10-14-11-20-16-7-5-4-6-15(14)16/h4-7,11-12,17,20H,3,8-10H2,1-2H3/t17-/m0/s1
InChIKey VVMSKBKWMALPJV-KRWDZBQOSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEaQ5xqNFrU
Name N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-2,3-didehydropiperidine
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Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-3-13-12-21(9-8-18(13)22)17(19(23)24-2)10-14-11-20-16-7-5-4-6-15(14)16/h4-7,11-12,17,20H,3,8-10H2,1-2H3/t17-/m0/s1
InChIKey VVMSKBKWMALPJV-KRWDZBQOSA-N
Molecular Weight 326.396 g/mol
SMILES [nH]1c2c(c(c1)C[C@](N1C=C(CC)C(CC1)=O)(C(=O)OC)[H])cccc2
SPLASH splash10-001i-0901000000-13aa65c6d6d06600293d
Source of Spectrum QE-3-150-28
Synonyms (3S)-3-(5-ethyl-4-oxo-3,4-dihydro-1(2H)-pyridinyl)-4-(1H-indol-3-yl)butanoic acid (S)-2-(5-Ethyl-4-oxo-3,4-dihydro-2H-pyridin-1-yl)-3-(1H-indol-3-yl)-propionic acid methyl ester N-((S)-1-methoxyCarbonyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-2,3-didehydropiperidine
Wiley ID 843022