MassBank Record: JP003326



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

ACCESSION: JP003326
RECORD_TITLE: ISOPROPYL PALMITATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: ISOPROPYL PALMITATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H38O2 CH$EXACT_MASS: 298.28718 CH$SMILES: CCCCCCCCCCCCCCCC(=O)OC(C)C CH$IUPAC: InChI=1S/C19H38O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(20)21-18(2)3/h18H,4-17H2,1-3H3
AC$INSTRUMENT: JEOL JMS-01-SG-2 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0pb9-9210000000-41597dc201ecf902b37f PK$NUM_PEAK: 51 PK$PEAK: m/z int. rel.int. 43 99.99 999 44 6 60 45 4.4 44 53 6.4 64 54 60 600 55 15.6 156 56 72.3 723 57 0.33 3 58 19.4 194 59 71.7 717 60 26.1 261 67 0.87 9 68 5.5 55 69 31.9 319 70 8.9 89 71 4.1 41 73 40.9 409 74 6.5 65 81 6.6 66 82 0.43 4 83 18.5 185 84 9.7 97 85 22 220 87 1.05 11 95 6.7 67 96 3.9 39 97 13.6 136 98 1.91 19 99 6.3 63 101 6.1 61 102 79.2 792 103 1.19 12 109 3.2 32 111 8.4 84 112 5.1 51 113 0.35 4 115 7.8 78 125 4.2 42 129 15.9 159 157 0.51 5 171 3.9 39 185 4.5 45 213 7 70 239 2.14 21 240 3.9 39 255 3 30 256 59.6 596 257 4.02 40 258 4.6 46 298 9 90 299 5.5 55 //