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(2S)-2-[4-[(1-carbomethoxy-2-keto-propyl)carbamoyl]-5-methyl-oxazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester
SpectraBase Compound ID D7uh3FqjQQ8
InChI InChI=1S/C22H25N3O7/c1-13(26)17(21(28)30-3)23-19(27)18-14(2)32-20(24-18)16-10-7-11-25(16)22(29)31-12-15-8-5-4-6-9-15/h4-6,8-9,16-17H,7,10-12H2,1-3H3,(H,23,27)/t16-,17?/m0/s1
InChIKey IDEUYFFUMUIYRE-BHWOMJMDSA-N
Mol Weight 443.46 g/mol
Molecular Formula C22H25N3O7
Exact Mass 443.16925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LowGx9b2TEN
Name (2S)-2-[4-[(1-carbomethoxy-2-keto-propyl)carbamoyl]-5-methyl-oxazol-2-yl]pyrrolidine-1-carboxylic acid benzyl ester
Alternate Name(s) (2S)-2-[4-[[(1-methoxy-1,3-dioxobutan-2-yl)amino]-oxomethyl]-5-methyl-2-oxazolyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester (phenylmethyl) (2S)-2-[4-[[1-methoxy-1,3-bis(oxidanylidene)butan-2-yl]carbamoyl]-5-methyl-1,3-oxazol-2-yl]pyrrolidine-1-carboxylate benzyl (2S)-2-[4-[(1-methoxy-1,3-dioxobutan-2-yl)carbamoyl]-5-methyl-1,3-oxazol-2-yl]pyrrolidine-1-carboxylate benzyl (2S)-2-[4-[(1-methoxycarbonyl-2-oxo-propyl)carbamoyl]-5-methyl-oxazol-2-yl]pyrrolidine-1-carboxylate
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Formula C22H25N3O7
InChI InChI=1S/C22H25N3O7/c1-13(26)17(21(28)30-3)23-19(27)18-14(2)32-20(24-18)16-10-7-11-25(16)22(29)31-12-15-8-5-4-6-9-15/h4-6,8-9,16-17H,7,10-12H2,1-3H3,(H,23,27)/t16-,17?/m0/s1
InChIKey IDEUYFFUMUIYRE-BHWOMJMDSA-N
Molecular Weight 443.456 g/mol
SMILES N(C(c1nc([C@]2(N(C(OCc3ccccc3)=O)CCC2)[H])oc1C)=O)C(C(=O)OC)C(=O)C
SPLASH splash10-0006-9010000000-6cd0cbc6776eecca1717
Source of Spectrum KC-0-598-16
Wiley ID 824464