MassBank of North America

Rating: ★★★☆☆

Name	Value
molecular formula Create New Query Add to Query	C19H34O8
total exact mass Create New Query Add to Query	390.22536804799995
SMILES Create New Query Add to Query	OCC1OC(OC2C(O)CC(C)(C)C(C=CC(O)C)C2C)C(O)C(O)C1O
InChI Create New Query Add to Query	InChI=1S/C19H34O8/c1-9(21)5-6-11-10(2)17(12(22)7-19(11,3)4)27-18-16(25)15(24)14(23)13(8-20)26-18/h5-6,9-18,20-25H,7-8H2,1-4H3
InChIKey Create New Query Add to Query	FPWYMVMNRFRHQC-UHFFFAOYSA-N

Name	Value
retention time Create New Query Add to Query	0.6952695039797068
ms level Create New Query Add to Query	MS2
formula Create New Query Add to Query	C19H34O8
exact mass Create New Query Add to Query	390.225368
spectrum entropy Create New Query Add to Query	4.1751366
origin Create New Query Add to Query	ead_pfp.msp
spectral entropy Create New Query Add to Query	4.134891981054725
normalized entropy Create New Query Add to Query	0.7685819467045392
ionization mode Create New Query Add to Query	positive
precursor m/z Create New Query Add to Query	413.214586
precursor type Create New Query Add to Query	[M+Na]+
mass accuracy Create New Query Add to Query	1.335983817315073 ppm
mass error Create New Query Add to Query	-5.520479999745476E-4 Da