MassBank of North America

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Name	Value
InChIKey Create New Query Add to Query	NZSCHTYUGUVLHG-WEVVVXLNSA-N
molecular formula Create New Query Add to Query	C15H22O2
total exact mass Create New Query Add to Query	234.161979944
SMILES Create New Query Add to Query	O=C(O)C(=CCCC1(C)C2CC3C(C2)C31C)C
InChI Create New Query Add to Query	InChI=1S/C15H22O2/c1-9(13(16)17)5-4-6-14(2)10-7-11-12(8-10)15(11,14)3/h5,10-12H,4,6-8H2,1-3H3,(H,16,17)/b9-5+

Name	Value
ms level Create New Query Add to Query	MS2
formula Create New Query Add to Query	C15H22O2
exact mass Create New Query Add to Query	234.1619799
retention time Create New Query Add to Query	9.294996975
spectrum entropy Create New Query Add to Query	1.3093024492263794
origin Create New Query Add to Query	hcd_lib.msp
ionization mode Create New Query Add to Query	negative
spectral entropy Create New Query Add to Query	1.3093024027664895
normalized entropy Create New Query Add to Query	0.6296413611650729
precursor m/z Create New Query Add to Query	293.1758309
precursor type Create New Query Add to Query	[M+HAc-H]-