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Propyl 3-(4-nitrophenyl)acetate
SpectraBase Compound ID Ihcl2TWVvtv
InChI InChI=1S/C11H13NO4/c1-2-7-16-11(13)8-9-3-5-10(6-4-9)12(14)15/h3-6H,2,7-8H2,1H3
InChIKey VHBMQOODWIGBSW-UHFFFAOYSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUqjgcCTtue
Name Propyl 3-(4-nitrophenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-2-7-16-11(13)8-9-3-5-10(6-4-9)12(14)15/h3-6H,2,7-8H2,1H3
InChIKey VHBMQOODWIGBSW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200900316
Molecular Weight 223.228 g/mol
SMILES c1cc(ccc1[N+](=O)[O-])CC(OCCC)=O
SPLASH splash10-002r-5930000000-84b220b51efa104c05c9
Source of Spectrum ASC-351-2091/SM5-5_2
Synonyms Propyl 2-(4-nitrophenyl)acetate Propyl 2-(4-nitrophenyl)ethanoate
Wiley ID 1763329