For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(4-(sec-butyl)phenyl)propan-2-one
SpectraBase Compound ID 2pU4BU4UTfT
InChI InChI=1S/C13H18O/c1-4-10(2)13-7-5-12(6-8-13)9-11(3)14/h5-8,10H,4,9H2,1-3H3
InChIKey SRUQZGQLUBPOEI-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Eoa5h4klAPb
Name 1-(4-(sec-butyl)phenyl)propan-2-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-4-10(2)13-7-5-12(6-8-13)9-11(3)14/h5-8,10H,4,9H2,1-3H3
InChIKey SRUQZGQLUBPOEI-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI positive ion
Literature Reference DOI 10.1002/anie.202002528
Molecular Weight 190.286 g/mol
Reported Formula C13H18O
SMILES c1cc(ccc1CC(C)=O)C(C)CC
SPLASH splash10-01ow-3900000000-d3784e606451955ec952
Source of Spectrum ACI-59-SM21-6p
Thin-Layer Chromatography Rf = 0.45 (Pentane/EtOAc, 5:1)
Wiley ID 1857931