MassBank Record: JP000192



 PARA FLUORO ISOBUTYLBENZOATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000192
RECORD_TITLE: PARA FLUORO ISOBUTYLBENZOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: PARA FLUORO ISOBUTYLBENZOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H13FO2 CH$EXACT_MASS: 196.08996 CH$SMILES: CC(C)COC(=O)c(c1)ccc(F)c1 CH$IUPAC: InChI=1S/C11H13FO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3
AC$INSTRUMENT: HITACHI RMU-7M AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00di-9700000000-c42cefa0da4a3d5d8ea2 PK$NUM_PEAK: 24 PK$PEAK: m/z int. rel.int. 27 6.01 60 29 7.13 71 39 7.04 70 41 14.6 146 43 2.75 28 50 3.69 37 51 2.15 22 55 2.06 21 56 37.8 378 57 3.35 34 68 1.12 11 69 2.58 26 74 1.72 17 75 19.76 198 76 1.37 14 94 2.66 27 95 43.64 436 96 2.58 26 97 2.15 22 123 99.99 999 124 6.96 70 140 1.2 12 141 20.62 206 142 1.29 13 //