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2-(benzyloxycarbonylamino)-4-bromo-butyric acid methyl ester
SpectraBase Compound ID 4JeQpwrQhyL
InChI InChI=1S/C13H16BrNO4/c1-18-12(16)11(7-8-14)15-13(17)19-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,17)
InChIKey VGIFEXOZPQIHJA-UHFFFAOYSA-N
Mol Weight 330.18 g/mol
Molecular Formula C13H16BrNO4
Exact Mass 329.026271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwaOBcjn0LZ
Name 2-(benzyloxycarbonylamino)-4-bromo-butyric acid methyl ester
Alternate Name(s) 4-Bromo-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester Methyl 4-bromanyl-2-(phenylmethoxycarbonylamino)butanoate Methyl 4-bromo-2-(phenylmethoxycarbonylamino)butanoate
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Formula C13H16BrNO4
InChI InChI=1S/C13H16BrNO4/c1-18-12(16)11(7-8-14)15-13(17)19-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,17)
InChIKey VGIFEXOZPQIHJA-UHFFFAOYSA-N
Molecular Weight 330.178 g/mol
SMILES N(C(C(=O)OC)CCBr)C(=O)OCc1ccccc1
SPLASH splash10-0006-9310000000-3f99c18d01bdc24b7348
Source of Spectrum SO-0-298-2
Wiley ID 1539204