MassBank Record: JP012306



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

ACCESSION: JP012306
RECORD_TITLE: UNDECYLBENZENE; CI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: IIDA YFAC. OF ENGINEERING, SEIKEI UNIV., DAISHIMA SFAC. OF ENGINEERING, SEIKEI UNIV., FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: UNDECYLBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H28 CH$EXACT_MASS: 232.21910 CH$SMILES: CCCCCCCCCCCc(c1)cccc1 CH$IUPAC: InChI=1S/C17H28/c1-2-3-4-5-6-7-8-9-11-14-17-15-12-10-13-16-17/h10,12-13,15-16H,2-9,11,14H2,1H3 CH$LINK: CAS 6742-54-7 CH$LINK: INCHIKEY XBEADGFTLHRJRB-UHFFFAOYSA-N
AC$INSTRUMENT: FINNIGAN-MAT 4500 AC$INSTRUMENT_TYPE: CI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-001i-1190000000-bd6bd0118e9946f91053 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 57 10.49 105 71 10.26 103 85 10.58 106 91 13.75 138 92 4.48 45 99 7.95 80 105 7.88 79 113 4.37 44 119 6.95 70 129 1.03 10 133 6.73 67 147 5.53 55 155 11.76 118 156 2.05 21 161 4.82 48 175 3.4 34 189 2.02 20 203 2.19 22 217 7.5 75 218 1.16 12 231 90.01 900 232 28.34 283 233 99.99 999 234 17.41 174 235 1.19 12 261 35.83 358 262 6.49 65 273 8.94 89 274 1.94 19 //