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(2S)-2-(4-nitrophenyl)propanoic acid
SpectraBase Compound ID JWk5xARLsDS
InChI InChI=1S/C9H9NO4/c1-6(9(11)12)7-2-4-8(5-3-7)10(13)14/h2-6H,1H3,(H,11,12)/t6-/m0/s1
InChIKey RBSRRICSXWXMRC-LURJTMIESA-N
Mol Weight 195.17 g/mol
Molecular Formula C9H9NO4
Exact Mass 195.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TOfzMaT5aD
Name (2S)-2-(4-nitrophenyl)propanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C9H9NO4
InChI InChI=1S/C9H9NO4/c1-6(9(11)12)7-2-4-8(5-3-7)10(13)14/h2-6H,1H3,(H,11,12)/t6-/m0/s1
InChIKey RBSRRICSXWXMRC-LURJTMIESA-N
Molecular Weight 195.174 g/mol
SMILES OC([C@](c1ccc(N(=O)=O)cc1)(C)[H])=O
SPLASH splash10-0udi-0900000000-20bbb22a7123a9b08b96
Source of Spectrum QC-12-3309-4
Wiley ID 1634917