MassBank Record: JP002526



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

ACCESSION: JP002526
RECORD_TITLE: N-HEPTYL ACETATE; 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$NAME: N-HEPTYL ACETATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H18O2 CH$EXACT_MASS: 158.13068 CH$SMILES: CCCCCCCOC(C)=O CH$IUPAC: InChI=1S/C9H18O2/c1-3-4-5-6-7-8-11-9(2)10/h3-8H2,1-2H3
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$SPLASH: splash10-052f-9000000000-f1ad3b37065aca66bd65 PK$NUM_PEAK: 31 PK$PEAK: m/z int. rel.int. 15 6.33 63 27 10.8 108 28 3.07 31 29 14.26 143 31 1.38 14 39 6.71 67 40 1.42 14 41 26.42 264 42 19.11 191 43 99.99 999 44 3 30 53 1.5 15 54 3.69 37 55 31.27 313 56 50.05 501 57 15.33 153 58 3.57 36 61 29.72 297 67 1.23 12 68 6.27 63 69 23.33 233 70 44.06 441 71 2.94 29 73 7.94 79 83 4.51 45 87 1.46 15 97 2.27 23 98 22.56 226 99 1.9 19 101 1.5 15 116 2.11 21 //