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4-nitrobenzoic acid benzyl ester
SpectraBase Compound ID 6YM0JLhsi8I
InChI InChI=1S/C14H11NO4/c16-14(19-10-11-4-2-1-3-5-11)12-6-8-13(9-7-12)15(17)18/h1-9H,10H2
InChIKey XCQFGJYVKKCUFX-UHFFFAOYSA-N
Mol Weight 257.24 g/mol
Molecular Formula C14H11NO4
Exact Mass 257.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4V2wBi5KCG
Name Benzyl 4-nitrobenzoate
Appearance Off-white crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO4
InChI InChI=1S/C14H11NO4/c16-14(19-10-11-4-2-1-3-5-11)12-6-8-13(9-7-12)15(17)18/h1-9H,10H2
InChIKey XCQFGJYVKKCUFX-UHFFFAOYSA-N
Instrument Name Agilent 7890-5977A
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900686
Molecular Weight 257.245 g/mol
SMILES C(c1ccc(cc1)[N+](=O)[O-])(=O)OCc1ccccc1
SPLASH splash10-0udl-8920000000-2d48090fcd5743619f10
Source of Spectrum ASC-361-SM21-1b
Wiley ID 1838006