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4-(Carboxymethyl)-4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-piperidinone
SpectraBase Compound ID 43THChvqJc9
InChI InChI=1S/C17H21NO5/c1-11-16(21)18(2)9-8-17(11,10-14(19)20)12-6-5-7-13(22-3)15(12)23-4/h5-7H,1,8-10H2,2-4H3,(H,19,20)
InChIKey CBZGCAOHKYHEDB-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C17H21NO5
Exact Mass 319.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9xJQxXg8sl
Name 4-(Carboxymethyl)-4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-piperidinone
CAS Registry Number 79619-11-7
Comments Less than 3 mono-isotopic peaks
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Formula C17H21NO5
InChI InChI=1S/C17H21NO5/c1-11-16(21)18(2)9-8-17(11,10-14(19)20)12-6-5-7-13(22-3)15(12)23-4/h5-7H,1,8-10H2,2-4H3,(H,19,20)
InChIKey CBZGCAOHKYHEDB-UHFFFAOYSA-N
Molecular Weight 319.357 g/mol
SMILES OC(CC1(C(C(=O)N(CC1)C)=C)c1c(c(OC)ccc1)OC)=O
SPLASH splash10-03di-0091000000-0c8e76c86c38bfb4b518
Source of Spectrum J-46-5071-0
Synonyms [4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-oxo-4-piperidinyl]acetic acid
Wiley ID 1319328