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(2S)-2-[[2-[2-[[(1S)-2-keto-2-methoxy-1-methyl-ethyl]carbamoyl]phenyl]benzoyl]amino]propionic acid methyl ester
SpectraBase Compound ID A2oZhqBVIQg
InChI InChI=1S/C22H24N2O6/c1-13(21(27)29-3)23-19(25)17-11-7-5-9-15(17)16-10-6-8-12-18(16)20(26)24-14(2)22(28)30-4/h5-14H,1-4H3,(H,23,25)(H,24,26)/t13-,14-/m0/s1
InChIKey IORPNUNQHNMUAL-KBPBESRZSA-N
Mol Weight 412.44 g/mol
Molecular Formula C22H24N2O6
Exact Mass 412.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nLLsxQ7Sy
Name (2S)-2-[[2-[2-[[(1S)-2-keto-2-methoxy-1-methyl-ethyl]carbamoyl]phenyl]benzoyl]amino]propionic acid methyl ester
Alternate Name(s) (2S)-2-[[[2-[2-[[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]phenyl]phenyl]-oxomethyl]amino]propanoic acid methyl ester Methyl (2S)-2-[[2-[2-[[(1S)-2-methoxy-1-methyl-2-oxo-ethyl]carbamoyl]phenyl]benzoyl]amino]propanoate Methyl (2S)-2-[[2-[2-[[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]phenyl]phenyl]carbonylamino]propanoate Methyl (2S)-2-[[2-[2-[[(2S)-1-methoxy-1-oxopropan-2-yl]carbamoyl]phenyl]benzoyl]amino]propanoate
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Formula C22H24N2O6
InChI InChI=1S/C22H24N2O6/c1-13(21(27)29-3)23-19(25)17-11-7-5-9-15(17)16-10-6-8-12-18(16)20(26)24-14(2)22(28)30-4/h5-14H,1-4H3,(H,23,25)(H,24,26)/t13-,14-/m0/s1
InChIKey IORPNUNQHNMUAL-KBPBESRZSA-N
Molecular Weight 412.442 g/mol
SMILES N(C(c1c(-c2c(C(N[C@](C(=O)OC)(C)[H])=O)cccc2)cccc1)=O)[C@](C(=O)OC)(C)[H]
SPLASH splash10-001i-0893000000-9f8f61fba75af60a6fa2
Source of Spectrum H-85-3635-6
Wiley ID 1524715