MassBank of North America

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Name	Value
InChIKey Create New Query Add to Query	CRVXJSNSTGEXDX-HHMSBIESSA-N
molecular formula Create New Query Add to Query	C15H20O7
total exact mass Create New Query Add to Query	312.12090298
SMILES Create New Query Add to Query	OCC=CC1=CC=C(OC2OC(CO)C(O)C(O)C2O)C=C1
InChI Create New Query Add to Query	InChI=1S/C15H20O7/c16-7-1-2-9-3-5-10(6-4-9)21-15-14(20)13(19)12(18)11(8-17)22-15/h1-6,11-20H,7-8H2/b2-1+/t11-,12-,13+,14-,15-/m1/s1

Name	Value
ms level Create New Query Add to Query	MS2
formula Create New Query Add to Query	C15H20O7
exact mass Create New Query Add to Query	312.120903
retention time Create New Query Add to Query	1.849698596
spectrum entropy Create New Query Add to Query	0.9909349083900452
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	0.990934905506899
normalized entropy Create New Query Add to Query	0.43035756138696646
precursor m/z Create New Query Add to Query	371.134754
precursor type Create New Query Add to Query	[M+HAc-H]-