MS of Geosmin

Geosmin

InChiKey: JLPUXFOGCDVKGO-TUAOUCFPSA-N
Retention index: SemiStdNP=1416 StdPolar=1809
Formula: C12H22O
Exact mass: 182.167066
Comments: Spectrum_id=DS-4 Smiles=C[C@H]1CCC[C@]2(C)[C@]1(O)CCCC2 Contributor=J.Dickschat,_Bonn_University;_S.Schulz;_TU-Braunschweig Reference=https://doi.org/10.1039/D4OB90071E Phase=Heavywax,_HP5-MS Mode=_Quadrupole,_Agilent_MSD Compound_class=Terpenoid Source=Scan_1991_SDG235.D License=CC_BY-SA Geosmin isomer
Structure of Geosmin