MassBank Record: JP001484



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

ACCESSION: JP001484
RECORD_TITLE: PELARGONALDEHYDE; 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$NAME: PELARGONALDEHYDE CH$NAME: NONANAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H18O CH$EXACT_MASS: 142.13577 CH$SMILES: CCCCCCCCC=O CH$IUPAC: InChI=1S/C9H18O/c1-2-3-4-5-6-7-8-9-10/h9H,2-8H2,1H3
AC$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: splash10-052f-9000000000-7bfee629e196af9e810a PK$NUM_PEAK: 48 PK$PEAK: m/z int. rel.int. 15 3.84 38 26 2.69 27 27 50.16 502 28 11.64 116 29 65.25 653 30 2.3 23 31 3.38 34 32 1.27 13 38 1.19 12 39 31.64 316 40 5.45 55 41 99.99 999 42 31.62 316 43 83.46 835 44 63.68 637 45 18.49 185 50 1.12 11 51 2.19 22 52 1.04 10 53 7.26 73 54 15.05 151 55 54.68 547 56 67.01 670 57 72.11 721 58 5.64 56 65 1.56 16 66 3.8 38 67 19.29 193 68 28.63 286 69 31.92 319 70 35.25 353 71 11.51 115 72 7.41 74 79 1.65 17 81 20.47 205 82 26.22 262 83 8.74 87 84 1.81 18 85 3.19 32 86 2.76 28 95 17.55 176 96 17.72 177 97 2.12 21 98 36.04 360 99 5.19 52 109 2.03 20 114 8.05 81 124 6.76 68 //