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3-(4-Chlorophenyl)-4-nitrobutanoic acid
SpectraBase Compound ID 7bLAm6m2bAB
InChI InChI=1S/C10H10ClNO4/c11-9-3-1-7(2-4-9)8(5-10(13)14)6-12(15)16/h1-4,8H,5-6H2,(H,13,14)
InChIKey KYJIWWFRFAYPGO-UHFFFAOYSA-N
Mol Weight 243.65 g/mol
Molecular Formula C10H10ClNO4
Exact Mass 243.029836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TE906u1LMm
Name 3-(4-Chlorophenyl)-4-nitrobutanoic acid
Alternate Name(s) 3-(4-Chlorophenyl)-4-nitro-butyric acid
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Formula C10H10ClNO4
InChI InChI=1S/C10H10ClNO4/c11-9-3-1-7(2-4-9)8(5-10(13)14)6-12(15)16/h1-4,8H,5-6H2,(H,13,14)
InChIKey KYJIWWFRFAYPGO-UHFFFAOYSA-N
Molecular Weight 243.646 g/mol
SMILES OC(CC(CN(=O)=O)c1ccc(cc1)Cl)=O
SPLASH splash10-001i-9300000000-6db9e05bc955e74624ba
Source of Spectrum B-47-1441-0
Wiley ID 1245826