MassBank Record: JP003325



 TETRAHYDROFURFURYL 9-OCTADECENOATE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003325
RECORD_TITLE: TETRAHYDROFURFURYL 9-OCTADECENOATE; 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$NAME: TETRAHYDROFURFURYL 9-OCTADECENOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C23H42O3 CH$EXACT_MASS: 366.31340 CH$SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(C1)OCC1 CH$IUPAC: InChI=1S/C23H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23(24)26-21-22-18-17-20-25-22/h9-10,22H,2-8,11-21H2,1H3/b10-9+
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$SPLASH: splash10-00di-9000000000-89c65d7f628beff2b926 PK$NUM_PEAK: 35 PK$PEAK: m/z int. rel.int. 53 3.3 33 54 38.5 385 55 7.5 75 56 17.9 179 67 17.6 176 68 6.5 65 69 15.3 153 70 0.62 6 71 99.99 999 72 5.6 56 79 3.9 39 80 0.23 2 81 11.4 114 82 8.2 82 83 10.4 104 84 3.84 38 85 41.9 419 95 7.8 78 96 6.8 68 97 0.62 6 98 16.7 167 100 3.3 33 109 4.2 42 110 0.36 4 111 3.3 33 112 5.8 58 123 2.9 29 137 0.33 3 144 4.3 43 152 2.6 26 157 2.6 26 264 1.22 12 265 3.7 37 366 5.9 59 367 2.6 26 //