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Butyl 4-nitrobenzoate
SpectraBase Compound ID BOaBSc18jGv
InChI InChI=1S/C11H13NO4/c1-2-3-8-16-11(13)9-4-6-10(7-5-9)12(14)15/h4-7H,2-3,8H2,1H3
InChIKey DVTGVOHTTDVRJF-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 L890znU8sOs
Name Butyl 4-nitrobenzoate
Appearance Yellow oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.084457899 u
Formula C11H13NO4
GC Column HP-5
InChI InChI=1S/C11H13NO4/c1-2-3-8-16-11(13)9-4-6-10(7-5-9)12(14)15/h4-7H,2-3,8H2,1H3
InChIKey DVTGVOHTTDVRJF-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003752
Molecular Weight 223.228 g/mol
Quality 160
SMILES C(CCC)OC(C1=CC=C(C=C1)[N+](=O)[O-])=O
SPLASH splash10-0zfr-4900000000-625c252c496875a5cd4a
Source of Spectrum QE-27-SM36-2h (DOI: 10.1002/chem.202003752)
Wiley ID 1903988