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Ethyl 2-(2-(4-nitrobenzoyl)phenyl)acetate
SpectraBase Compound ID 7ISQHS0Sul7
InChI InChI=1S/C17H15NO5/c1-2-23-16(19)11-13-5-3-4-6-15(13)17(20)12-7-9-14(10-8-12)18(21)22/h3-10H,2,11H2,1H3
InChIKey KXIQSRNGPWWMDI-UHFFFAOYSA-N
Mol Weight 313.31 g/mol
Molecular Formula C17H15NO5
Exact Mass 313.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYf4VEAad0b
Name Ethyl 2-(2-(4-nitrobenzoyl)phenyl)acetate
Alternate Name(s) 2-[2-[(4-nitrophenyl)-oxomethyl]phenyl]acetic acid ethyl ester Ethyl 2-[2-(4-nitrobenzoyl)phenyl]acetate Ethyl 2-[2-(4-nitrophenyl)carbonylphenyl]ethanoate
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Formula C17H15NO5
InChI InChI=1S/C17H15NO5/c1-2-23-16(19)11-13-5-3-4-6-15(13)17(20)12-7-9-14(10-8-12)18(21)22/h3-10H,2,11H2,1H3
InChIKey KXIQSRNGPWWMDI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300529j
Molecular Weight 313.309 g/mol
SMILES c1cccc(C(c2ccc(cc2)[N+](=O)[O-])=O)c1CC(OCC)=O
SPLASH splash10-014r-0950000000-f04dd55f73ba2dce6da1
Source of Spectrum A1-14-2022/SMS19-6d
Wiley ID 1750249