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[2-(-2'-Oxo-4'-phenylazetidin-1'-yl)acetyl]-L-phenylalanine - methyl ester

View entire compound with spectra: 2 MS (GC)

[2-(<S>-2'-Oxo-4'-phenylazetidin-1'-yl)acetyl]-L-phenylalanine - methyl ester
SpectraBase Compound ID ARcP81w8f2H
InChI InChI=1S/C21H22N2O4/c1-27-21(26)17(12-15-8-4-2-5-9-15)22-19(24)14-23-18(13-20(23)25)16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H,22,24)/t17-,18-/m0/s1
InChIKey NJMWNMGSFWPUIC-ROUUACIJSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SmF2jjOA3u
Name [2-(-2'-Oxo-4'-phenylazetidin-1'-yl)acetyl]-L-phenylalanine - methyl ester
Alternate Name(s) {2-[(S)-2-Oxo-4-phenylazetidin-1-yl]acetyl}-L-phenylalanine Methyl Ester (S)-methyl 2-(2-((S)-2-oxo-4-phenylazetidin-1-yl)acetamido)-3-phenylpropanoate
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Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c1-27-21(26)17(12-15-8-4-2-5-9-15)22-19(24)14-23-18(13-20(23)25)16-10-6-3-7-11-16/h2-11,17-18H,12-14H2,1H3,(H,22,24)/t17-,18-/m0/s1
InChIKey NJMWNMGSFWPUIC-ROUUACIJSA-N
Molecular Weight 366.417 g/mol
SMILES N(C(CN1C(=O)C[C@]1(c1ccccc1)[H])=O)[C@](C(=O)OC)(Cc1ccccc1)[H]
SPLASH splash10-07w9-0911000000-87764a26f97ba6595ad9
Source of Spectrum D8-333-248-12
Wiley ID 1516865