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2-(benzyloxycarbonylamino)-4-keto-4-methoxy-butyric acid
SpectraBase Compound ID EpGRu7QBAUY
InChI InChI=1S/C13H15NO6/c1-19-11(15)7-10(12(16)17)14-13(18)20-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,14,18)(H,16,17)
InChIKey PHMBNDDHIBIDRQ-UHFFFAOYSA-N
Mol Weight 281.26 g/mol
Molecular Formula C13H15NO6
Exact Mass 281.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95VnW437vXo
Name 2-(benzyloxycarbonylamino)-4-keto-4-methoxy-butyric acid
Alternate Name(s) 2-{[(benzyloxy)carbonyl]amino}-4-methoxy-4-oxobutanoic acid 4-Methoxy-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoic acid 4-Methoxy-4-oxo-2-(phenylmethoxycarbonylamino)butanoic acid
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Formula C13H15NO6
InChI InChI=1S/C13H15NO6/c1-19-11(15)7-10(12(16)17)14-13(18)20-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,14,18)(H,16,17)
InChIKey PHMBNDDHIBIDRQ-UHFFFAOYSA-N
Molecular Weight 281.264 g/mol
SMILES N(C(C(=O)O)CC(=O)OC)C(=O)OCc1ccccc1
SPLASH splash10-0006-9200000000-0b21d9b53cd2e928b70d
Source of Spectrum F-53-16591-43
Wiley ID 804617