MassBank Record: JP001556



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

ACCESSION: JP001556
RECORD_TITLE: CYCLOOCTENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: CYCLOOCTENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H14 CH$EXACT_MASS: 110.10955 CH$SMILES: C(C1)CCC=CCC1 CH$IUPAC: InChI=1S/C8H14/c1-2-4-6-8-7-5-3-1/h1-2H,3-8H2/b2-1-
AC$INSTRUMENT: HITACHI RMU-6M AC$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$SPLASH: splash10-0gc3-9000000000-7e2958cf3e602fe1f7d4 PK$NUM_PEAK: 40 PK$PEAK: m/z int. rel.int. 15 1.56 16 26 2.19 22 27 27.26 273 28 6.89 69 29 11.41 114 38 2.31 23 39 42.47 425 40 8.09 81 41 74.54 745 42 7.49 75 43 4.26 43 50 2.58 26 51 6.23 62 52 3.6 36 53 18.18 182 54 81.04 810 55 24.32 243 56 10.1 101 63 1.44 14 65 5.24 52 66 6.02 60 67 99.99 999 68 39.2 392 69 16.12 161 70 2.82 28 77 4.32 43 78 1.26 13 79 6.95 70 80 3.54 35 81 45.07 451 82 67.51 675 83 5.54 55 84 1.2 12 91 1.68 17 93 1.2 12 94 17.43 174 95 1.53 15 109 1.14 11 110 36.6 366 111 3.18 32 //