MassBank Record: JP002892



 3-CHLORO-4-HYDROXY PHENYL ACETIC ACID; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002892
RECORD_TITLE: 3-CHLORO-4-HYDROXY PHENYL ACETIC ACID; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 3-CHLORO-4-HYDROXY PHENYL ACETIC ACID CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H7ClO3 CH$EXACT_MASS: 186.00837 CH$SMILES: OC(=O)Cc(c1)cc(Cl)c(O)c1 CH$IUPAC: InChI=1S/C8H7ClO3/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3,10H,4H2,(H,11,12)
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-5900000000-d67134b1307205aa5015 PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 27 3.05 31 28 10.33 103 38 5.04 50 39 3.72 37 44 6.29 63 45 3.05 31 50 6.86 69 51 22.13 221 52 5.64 56 53 4.79 48 56 2.1 21 62 2.1 21 63 2.52 25 71 2.58 26 73 2.19 22 74 2.02 20 75 3.32 33 77 32.52 325 78 5.57 56 105 7.47 75 107 6.22 62 112 2.58 26 140 4.38 44 141 99.99 999 142 10.02 100 143 37.4 374 144 3.19 32 186 34.23 342 187 2.9 29 188 10.77 108 //