MassBank Record: JP003372



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

ACCESSION: JP003372
RECORD_TITLE: ISOPROPYL MYRISTATE; 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$NAME: ISOPROPYL MYRISTATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H34O2 CH$EXACT_MASS: 270.25588 CH$SMILES: CCCCCCCCCCCCCC(=O)OC(C)C CH$IUPAC: InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3
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$SPLASH: splash10-0pb9-9320000000-555fda071da050d8d712 PK$NUM_PEAK: 54 PK$PEAK: m/z int. rel.int. 44 5.1 51 45 5.8 58 54 60.8 608 55 10.8 108 56 60.7 607 57 0.22 2 58 22.2 222 59 78.5 785 60 27 270 67 0.5 5 68 4.3 43 69 23.6 236 70 7.7 77 71 2.86 29 72 2 20 73 34.5 345 74 8.2 82 81 0.55 6 82 3.4 34 83 14.3 143 84 8.2 82 85 1.64 16 87 10.8 108 95 6.1 61 96 2.2 22 97 1.18 12 98 8.7 87 99 5.7 57 101 5.1 51 102 99.99 999 103 12.8 128 109 2.5 25 111 6.5 65 112 0.22 2 113 3.4 34 115 6.5 65 116 2.3 23 125 0.27 3 129 19.2 192 143 5.7 57 157 2.2 22 168 0.22 2 171 4.1 41 185 9.8 98 209 2.2 22 211 3.3 33 212 4.8 48 227 5.1 51 228 64.6 646 229 5.61 56 230 7.7 77 270 12.8 128 271 26 260 272 4 40 //