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4-[(2E)-4,4-dimethyl-2-phenacylidene-1-pyrrolidinyl]butanoic acid
SpectraBase Compound ID CN4x5eFb0sq
InChI InChI=1S/C18H23NO3/c1-18(2)12-15(19(13-18)10-6-9-17(21)22)11-16(20)14-7-4-3-5-8-14/h3-5,7-8,11H,6,9-10,12-13H2,1-2H3,(H,21,22)/b15-11+
InChIKey CVAWREPQSVQGBY-RVDMUPIBSA-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 6DpcU9gIfwT
Name 4-[(2E)-4,4-dimethyl-2-phenacylidene-1-pyrrolidinyl]butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO3
InChI InChI=1S/C18H23NO3/c1-18(2)12-15(19(13-18)10-6-9-17(21)22)11-16(20)14-7-4-3-5-8-14/h3-5,7-8,11H,6,9-10,12-13H2,1-2H3,(H,21,22)/b15-11+
InChIKey CVAWREPQSVQGBY-RVDMUPIBSA-N
Molecular Weight 301.386 g/mol
SMILES OC(CCCN1\C(=C\C(=O)c2ccccc2)CC(C)(C)C1)=O
SPLASH splash10-004i-0391000000-e6814e58f11e2b37d501
Source of Spectrum D8-330-79-4
Synonyms 4-[4,4-Dimethyl-2-(2-oxo-2-phenyl-ethylidene)-pyrrolidin-1-yl]butyric acid 4-[(2E)-4,4-dimethyl-2-phenacylidene-pyrrolidin-1-yl]butanoic acid 4-[(2E)-4,4-dimethyl-2-phenacylidene-pyrrolidino]butyric acid (E)-4-(4,4-dimethyl-2-(2-oxo-2-phenylethylidene)pyrrolidin-1-yl)butanoic acid 4-[(2E)-4,4-dimethyl-2-phenacylidenepyrrolidin-1-yl]butanoic acid
Wiley ID 1516363