MassBank Record: JP001329



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

ACCESSION: JP001329
RECORD_TITLE: 1-HEPTANOL; 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$NAME: 1-HEPTANOL CH$NAME: HEPTYL ALCOHOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H16O CH$EXACT_MASS: 116.12012 CH$SMILES: CCCCCCCO CH$IUPAC: InChI=1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3
AC$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: splash10-0006-9000000000-d5f79579e8c1fb0a32e5 PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 15 1.25 13 18 3.9 39 26 2.02 20 27 38.97 390 28 13.22 132 29 52.89 529 30 1.25 13 31 43.22 432 39 25.47 255 40 4.8 48 41 99.99 999 42 55.53 555 43 70.98 710 44 6.61 66 45 3.41 34 53 2.64 26 54 2.3 23 55 27.77 278 56 27.28 273 57 8.35 84 68 2.92 29 69 11.27 113 70 20.39 204 71 1.32 13 83 1.74 17 //