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Ethyl 2-(2-bromo-N-((S)-1-phenylpropyl)propanamido)acetate
SpectraBase Compound ID K0oUJ4uq1Pu
InChI InChI=1S/C16H22BrNO3/c1-4-14(13-9-7-6-8-10-13)18(16(20)12(3)17)11-15(19)21-5-2/h6-10,12,14H,4-5,11H2,1-3H3/t12-,14?/m0/s1
InChIKey RCEZZOAXUVARAG-NBFOIZRFSA-N
Mol Weight 356.26 g/mol
Molecular Formula C16H22BrNO3
Exact Mass 355.078307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yaIa8eOzF
Name Ethyl 2-(2-bromo-N-((S)-1-phenylpropyl)propanamido)acetate
Alternate Name(s) Ethyl 2-((2S)-2-bromo-N-(1-phenylpropyl)propanamido)acetate
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Formula C16H22BrNO3
InChI InChI=1S/C16H22BrNO3/c1-4-14(13-9-7-6-8-10-13)18(16(20)12(3)17)11-15(19)21-5-2/h6-10,12,14H,4-5,11H2,1-3H3/t12-,14?/m0/s1
InChIKey RCEZZOAXUVARAG-NBFOIZRFSA-N
Molecular Weight 356.260 g/mol
SMILES C(CN(C([C@](C)(Br)[H])=O)C(CC)c1ccccc1)(=O)OCC
SPLASH splash10-0006-9840000000-80c10e313b943aee50a0
Source of Spectrum ASC-349-2177/SM7-1i
Wiley ID 1765393