MassBank of North America

Rating: ★★★☆☆

Name	Value
InChI Create New Query Add to Query	InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3
InChIKey Create New Query Add to Query	ZFRKQXVRDFCRJG-UHFFFAOYSA-N
molecular formula Create New Query Add to Query	C9H9N
total exact mass Create New Query Add to Query	131.073499288
SMILES Create New Query Add to Query	C=1C=CC2=C(C1)NC=C2C

Name	Value
sample introduction Create New Query Add to Query	Liquid Chromatography (LC)
ms level Create New Query Add to Query	MS2
ionization Create New Query Add to Query	Electrospray Ionization (ESI)
author Create New Query Add to Query	Elys Rodriguez
spectral entropy Create New Query Add to Query	1.6925765463106779
normalized entropy Create New Query Add to Query	0.4723224783736993
ionization mode Create New Query Add to Query	positive
precursor m/z Create New Query Add to Query	132.0735
precursor type Create New Query Add to Query	[M+H]
mass accuracy Create New Query Add to Query	60.33979564407839 ppm
mass error Create New Query Add to Query	-0.007969287999998187 Da