MassBank of North America

Rating: ★★★☆☆

Name	Value
InChIKey Create New Query Add to Query	SBHXYTNGIZCORC-UHFFFAOYSA-N
molecular formula Create New Query Add to Query	C15H12O6
total exact mass Create New Query Add to Query	288.06338810399996
SMILES Create New Query Add to Query	O=C1C=2C(O)=CC(O)=CC2OC(C3=CC=C(O)C(O)=C3)C1
InChI Create New Query Add to Query	InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2

Name	Value
ms level Create New Query Add to Query	MS2
formula Create New Query Add to Query	C15H12O6
exact mass Create New Query Add to Query	288.0633881
retention time Create New Query Add to Query	3.350099881
spectrum entropy Create New Query Add to Query	1.112697720527649
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	1.1126977296461333
normalized entropy Create New Query Add to Query	0.571813518823733
precursor m/z Create New Query Add to Query	287.0561116
precursor type Create New Query Add to Query	[M-H]-
mass accuracy Create New Query Add to Query	0.0017557541402857164 ppm
mass error Create New Query Add to Query	-5.039999564360187E-7 Da