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(2S)-1-(4-benzoxy-3-methoxy-benzoyl)pyrrolidine-2-carboxylic acid methyl ester
SpectraBase Compound ID 2VqtU0pcaHz
InChI InChI=1S/C21H23NO5/c1-25-19-13-16(20(23)22-12-6-9-17(22)21(24)26-2)10-11-18(19)27-14-15-7-4-3-5-8-15/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3/t17-/m0/s1
InChIKey BFDYMHGIDAVGAS-KRWDZBQOSA-N
Mol Weight 369.42 g/mol
Molecular Formula C21H23NO5
Exact Mass 369.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxwSYXpXyjK
Name (2S)-1-(4-benzoxy-3-methoxy-benzoyl)pyrrolidine-2-carboxylic acid methyl ester
Alternate Name(s) (2S)-1-[(3-methoxy-4-phenylmethoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester Methyl (2S)-1-(3-methoxy-4-phenylmethoxy-phenyl)carbonylpyrrolidine-2-carboxylate Methyl (2S)-1-(3-methoxy-4-phenylmethoxybenzoyl)pyrrolidine-2-carboxylate Methyl (2S)-1-(4-benzyloxy-3-methoxy-benzoyl)pyrrolidine-2-carboxylate
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Formula C21H23NO5
InChI InChI=1S/C21H23NO5/c1-25-19-13-16(20(23)22-12-6-9-17(22)21(24)26-2)10-11-18(19)27-14-15-7-4-3-5-8-15/h3-5,7-8,10-11,13,17H,6,9,12,14H2,1-2H3/t17-/m0/s1
InChIKey BFDYMHGIDAVGAS-KRWDZBQOSA-N
Molecular Weight 369.417 g/mol
SMILES C(N1[C@](C(=O)OC)(CCC1)[H])(c1cc(OC)c(cc1)OCc1ccccc1)=O
SPLASH splash10-0006-9011000000-9243e1569e622f74974a
Source of Spectrum F-70-2260-9
Wiley ID 1596522