MassBank of North America

Rating: ★★★☆☆

Name	Value
InChIKey Create New Query Add to Query	FMGSKLZLMKYGDP-USOAJAOKSA-N
molecular formula Create New Query Add to Query	C19H28O2
total exact mass Create New Query Add to Query	288.208930136
SMILES Create New Query Add to Query	O=C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
InChI Create New Query Add to Query	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14-,15-,16-,18-,19-/m0/s1

Name	Value
ms level Create New Query Add to Query	MS2
formula Create New Query Add to Query	C19H28O2
exact mass Create New Query Add to Query	288.2089301
retention time Create New Query Add to Query	5.698987679
spectrum entropy Create New Query Add to Query	2.862443685531616
origin Create New Query Add to Query	hcd_lib.msp
ionization mode Create New Query Add to Query	positive
spectral entropy Create New Query Add to Query	2.8624438022593557
normalized entropy Create New Query Add to Query	0.8785632251393044
precursor m/z Create New Query Add to Query	289.2162066
precursor type Create New Query Add to Query	[M+H]+
mass accuracy Create New Query Add to Query	2.3979845670639293 ppm
mass error Create New Query Add to Query	-6.935359999715729E-4 Da