MassBank Record: JP008739



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

ACCESSION: JP008739
RECORD_TITLE: DELTA-TRIDECALACTONE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: DELTA-TRIDECALACTONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H24O2 CH$EXACT_MASS: 212.17763 CH$SMILES: CCCCCCCCC(C1)OC(=O)CC1 CH$IUPAC: InChI=1S/C13H24O2/c1-2-3-4-5-6-7-9-12-10-8-11-13(14)15-12/h12H,2-11H2,1H3 CH$LINK: INCHIKEY RZZLMGATMUAJPX-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80B 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: splash10-006y-9000000000-c87bb6f0150dea0c3ff2 PK$NUM_PEAK: 55 PK$PEAK: m/z int. rel.int. 27 18.7 187 28 2.41 24 29 22.95 230 39 12.63 126 40 2.3 23 41 49.85 499 42 33.02 330 43 38.65 387 44 2.03 20 53 3.04 30 54 4.98 50 55 38.85 389 56 16.54 165 57 13.82 138 58 2.04 20 60 1.9 19 67 5.08 51 68 6.59 66 69 18.77 188 70 31.88 319 71 37.03 370 72 1.46 15 73 2.67 27 81 3.62 36 82 3.48 35 83 7.01 70 84 5.97 60 85 1.41 14 86 2.28 23 87 1.13 11 95 2.27 23 96 4.63 46 97 6.06 61 98 6.28 63 99 99.99 999 100 5.06 51 109 1.29 13 110 3.13 31 111 2.63 26 112 1.42 14 114 12.65 127 115 2.2 22 123 1.5 15 124 1.35 14 125 1.28 13 127 1.1 11 134 1.02 10 137 1.2 12 141 2.05 21 142 1.3 13 150 3.91 39 151 1.39 14 152 2.16 22 176 1.3 13 194 2.01 20 //