MS of 3-Ethylheptan-2-one

3-Ethylheptan-2-one

InChiKey: PPKSOKLRYCVQPM-UHFFFAOYSA-N
Retention index: StdNP=1010 StdPolar=1270
Formula: C9H18O
Exact mass: 142.135765
Comments: Spectrum_id=DI-240 Smiles=CCCCC(CC)C(C)=O Contributor=N.Moennigmann,_S.Schulz;_TU-Braunschweig Reference=ht1tp://dx.doi.org/10.1016/j.cub.2014.01.073 Phase=OV-1, TC-WAX Mode=Agilent_quadrupole Compound_class=Ketone Source=Digitized License=CC_BY-SA goat pheromone
Structure of 3-Ethylheptan-2-one