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Ethyl 4-butyl-benzoate
SpectraBase Compound ID 1J7SSfjo7NK
InChI InChI=1S/C13H18O2/c1-3-5-6-11-7-9-12(10-8-11)13(14)15-4-2/h7-10H,3-6H2,1-2H3
InChIKey NKAVJELRFJVPEE-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJ9htXh0oyD
Name Ethyl 4-butyl-benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-3-5-6-11-7-9-12(10-8-11)13(14)15-4-2/h7-10H,3-6H2,1-2H3
InChIKey NKAVJELRFJVPEE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201406408
Molecular Weight 206.285 g/mol
Quality 79
Reported Formula C13H18O2
SMILES C1=CC(=CC=C1CCCC)C(=O)OCC
SPLASH splash10-03di-3940000000-c2ea2b92f8cbfce16e5d
Source of Spectrum QE-21-SM44-44-1 (DOI: 10.1002/chem.201406408)
Wiley ID 1909081