MassBank Record: JP000283



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

ACCESSION: JP000283
RECORD_TITLE: 1-HEPTANOL; 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$NAME: 1-HEPTANOL CH$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-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: splash10-0596-9000000000-93440ca41816ed93e8b5 PK$NUM_PEAK: 31 PK$PEAK: m/z int. rel.int. 15 2.3 23 19 1.4 14 26 1.5 15 27 3.05 31 28 8.8 88 29 36.1 361 30 1.2 12 31 3.37 34 39 19.5 195 40 3.9 39 41 81.5 815 42 5.18 52 43 71.5 715 44 2.9 29 45 4.8 48 51 0.11 1 53 3.8 38 54 6 60 55 72 720 56 9.44 94 57 24 240 67 2.1 21 68 15.3 153 69 5.12 51 70 99.99 999 71 5.9 59 72 2.1 21 83 0.83 8 97 1.2 12 98 9 90 99 1 10 //