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2-[(2E)-2-[2-keto-2-(p-tolyl)ethylidene]-4,4-dimethyl-pyrrolidino]propionic acid
SpectraBase Compound ID IsNdqh0Eh8e
InChI InChI=1S/C18H23NO3/c1-12-5-7-14(8-6-12)16(20)9-15-10-18(3,4)11-19(15)13(2)17(21)22/h5-9,13H,10-11H2,1-4H3,(H,21,22)/b15-9+
InChIKey FYQNBXZURPJHEW-OQLLNIDSSA-N
Mol Weight 301.39 g/mol
Molecular Formula C18H23NO3
Exact Mass 301.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fa5cRMTKY7H
Name 2-[(2E)-2-[2-keto-2-(p-tolyl)ethylidene]-4,4-dimethyl-pyrrolidino]propionic acid
Alternate Name(s) 2-[4,4-Dimethyl-2-(2-oxo-2-p-tolyl-ethylidene)-pyrrolidin-1-yl]-propionic acid 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethylidene]pyrrolidin-1-yl]propanoic acid 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxoethylidene]-1-pyrrolidinyl]propanoic acid 2-[(2E)-4,4-dimethyl-2-[2-(4-methylphenyl)-2-oxoethylidene]pyrrolidin-1-yl]propanoic acid (E)-2-(4,4-dimethyl-2-(2-oxo-2-(p-tolyl)ethylidene)pyrrolidin-1-yl)propanoic acid 2-[(2E)-4,4-dimethyl-2-[2-oxo-2-(p-tolyl)ethylidene]pyrrolidin-1-yl]propanoic acid
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Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-12-5-7-14(8-6-12)16(20)9-15-10-18(3,4)11-19(15)13(2)17(21)22/h5-9,13H,10-11H2,1-4H3,(H,21,22)/b15-9+
InChIKey FYQNBXZURPJHEW-OQLLNIDSSA-N
Literature Reference DOI 10.1002/ardp.19973300307
Molecular Weight 301.386 g/mol
SMILES OC(C(C)N1\C(CC(C1)(C)C)=C/C(c1ccc(cc1)C)=O)=O
SPLASH splash10-000l-0492000000-e67b8e962464df4f0e99
Source of Spectrum APP-330-81-5d
Wiley ID 1770186