MassBank Record: KO001526



 Naproxen; LC-ESI-QQ; MS2; CE:40 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001526
RECORD_TITLE: Naproxen; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID N018

CH$NAME: Naproxen CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H14O3 CH$EXACT_MASS: 230.09429 CH$SMILES: COc(c2)cc(c1)c(c2)cc(c1)C(C)C(O)=O CH$IUPAC: InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1 CH$LINK: CAS 22204-53-1 CH$LINK: KEGG C01517 CH$LINK: NIKKAJI J9.289D CH$LINK: PUBCHEM SID:4682
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40 V
MS$FOCUSED_ION: PRECURSOR_M/Z 229 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-014i-0900000000-6c076658da1c69f1b909 PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 79.200 108911.0 18 169.200 5970303.0 999 170.300 336634.0 56 //