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benzoic acid, p-nitrophenyl ester
SpectraBase Compound ID BnLRiLL90aS
InChI InChI=1S/C13H9NO4/c15-13(10-4-2-1-3-5-10)18-12-8-6-11(7-9-12)14(16)17/h1-9H
InChIKey GMKZBFFLCONHDE-UHFFFAOYSA-N
Mol Weight 243.22 g/mol
Molecular Formula C13H9NO4
Exact Mass 243.053158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FH2cEjidnvb
Name p-Nitrophenyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NO4
InChI InChI=1S/C13H9NO4/c15-13(10-4-2-1-3-5-10)18-12-8-6-11(7-9-12)14(16)17/h1-9H
InChIKey GMKZBFFLCONHDE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200404132
Molecular Weight 243.218 g/mol
SMILES c1c(OC(c2ccccc2)=O)ccc([N+](=O)[O-])c1
SPLASH splash10-0a4i-2900000000-24d6fa7dd1bf14390c70
Source of Spectrum ASC-346-1469-1469_7
Synonyms Benzoic acid (4-nitrophenyl) ester (4-nitrophenyl) benzoate 4-Nitrophenyl benzoate
Wiley ID 1767502