MassBank Record: WA000168



 1-Naphthaleneacetic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA000168
RECORD_TITLE: 1-Naphthaleneacetic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: 1-Naphthaleneacetic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H10O2 CH$EXACT_MASS: 186.06808 CH$SMILES: OC(=O)Cc(c1)c(c2)c(ccc2)cc1 CH$IUPAC: InChI=1S/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14) CH$LINK: CAS 86-87-3 CH$LINK: INCHIKEY PRPINYUDVPFIRX-UHFFFAOYSA-N
AC$INSTRUMENT: QuattroPremier XE, Waters AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]- MS$FOCUSED_ION: PRECURSOR_M/Z 184.9 MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0006-0900000000-e991c3d90e13bfbec33d PK$NUM_PEAK: 2 PK$PEAK: m/z int. rel.int. 141 999 999 185 12 12 //