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2-[(2E)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethylidene]-4,4-dimethyl-pyrrolidin-1-yl]propanoic acid
SpectraBase Compound ID 5mdoHtAPSpY
InChI InChI=1S/C18H23NO4/c1-12(17(21)22)19-11-18(2,3)10-14(19)9-16(20)13-5-7-15(23-4)8-6-13/h5-9,12H,10-11H2,1-4H3,(H,21,22)/b14-9+
InChIKey JJYWEFLKIGBZKA-NTEUORMPSA-N
Mol Weight 317.39 g/mol
Molecular Formula C18H23NO4
Exact Mass 317.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2piQHxq3tHq
Name 2-[(2E)-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethylidene]-4,4-dimethyl-pyrrolidin-1-yl]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO4
InChI InChI=1S/C18H23NO4/c1-12(17(21)22)19-11-18(2,3)10-14(19)9-16(20)13-5-7-15(23-4)8-6-13/h5-9,12H,10-11H2,1-4H3,(H,21,22)/b14-9+
InChIKey JJYWEFLKIGBZKA-NTEUORMPSA-N
Literature Reference DOI 10.1002/ardp.19973300307
Molecular Weight 317.385 g/mol
SMILES OC(C(C)N1\C(CC(C1)(C)C)=C/C(=O)c1ccc(cc1)OC)=O
SPLASH splash10-000f-0942000000-5dece20771fc11fc9606
Source of Spectrum APP-330-81-5c
Synonyms 2-{2-[2-(4-Methoxy-phenyl)-2-oxo-ethylidene]-4,4-dimethyl-pyrrolidin-1-yl}-propionic acid 2-[(2E)-2-[2-(4-methoxyphenyl)-2-oxo-ethylidene]-4,4-dimethyl-pyrrolidin-1-yl]propanoic acid 2-[(2E)-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-4,4-dimethyl-1-pyrrolidinyl]propanoic acid 2-[(2E)-2-[2-keto-2-(4-methoxyphenyl)ethylidene]-4,4-dimethyl-pyrrolidino]propionic acid (E)-2-(2-(2-(4-methoxyphenyl)-2-oxoethylidene)-4,4-dimethylpyrrolidin-1-yl)propanoic acid 2-[(2E)-2-[2-(4-methoxyphenyl)-2-oxoethylidene]-4,4-dimethylpyrrolidin-1-yl]propanoic acid
Wiley ID 1770185