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Acetic acid, phenoxy-, 3-nitrophenyl ester
SpectraBase Compound ID 7FtAfGlEilQ
InChI InChI=1S/C14H11NO5/c16-14(10-19-12-6-2-1-3-7-12)20-13-8-4-5-11(9-13)15(17)18/h1-9H,10H2
InChIKey SJDJYCKFBQRZDZ-UHFFFAOYSA-N
Mol Weight 273.24 g/mol
Molecular Formula C14H11NO5
Exact Mass 273.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aUH5a4Cflz
Name Acetic acid, phenoxy-, 3-nitrophenyl ester
Alternate Name(s) (3-nitrophenyl) 2-phenoxyacetate (3-nitrophenyl) 2-phenoxyethanoate 2-phenoxyacetic acid (3-nitrophenyl) ester
CAS Registry Number 29234-84-2
Comments Less than 3 mono-isotopic peaks
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Formula C14H11NO5
InChI InChI=1S/C14H11NO5/c16-14(10-19-12-6-2-1-3-7-12)20-13-8-4-5-11(9-13)15(17)18/h1-9H,10H2
InChIKey SJDJYCKFBQRZDZ-UHFFFAOYSA-N
Molecular Weight 273.244 g/mol
SMILES c1(N(=O)=O)cc(OC(=O)COc2ccccc2)ccc1
SPLASH splash10-0a4i-0900000000-6a4272c492d90c1b458f
Source of Spectrum O-22-406-20
Wiley ID 1277139