MassBank Record: JP002847



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

ACCESSION: JP002847
RECORD_TITLE: EPI-BETA-SANTALENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: EPI-BETA-SANTALENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H24 CH$EXACT_MASS: 204.18780 CH$SMILES: CC(C)=CCCC(C)(C(=C)1)C([H])(C2)CC([H])(C2)1 CH$IUPAC: InChI=1S/C15H24/c1-11(2)6-5-9-15(4)12(3)13-7-8-14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14+,15-/m1/s1
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9200000000-571f60ce8a1229229afd PK$NUM_PEAK: 61 PK$PEAK: m/z int. rel.int. 26 0.5 5 27 5.2 52 28 2.5 25 29 0.46 5 39 7.3 73 40 1 10 41 33.3 333 42 0.15 2 43 4.2 42 51 1.5 15 52 1 10 53 0.68 7 54 1 10 55 13.5 135 56 0.8 8 57 0.06 1 63 0.6 6 65 3.8 38 66 2 20 67 1.52 15 68 1.8 18 69 16.8 168 70 1 10 75 0.05 1 77 10 100 78 2.3 23 79 20.6 206 80 0.22 2 81 6.8 68 82 5.5 55 83 2.7 27 91 1.25 13 92 3.5 35 93 25.5 255 94 99.99 999 95 1.15 12 96 0.8 8 103 0.6 6 105 5.8 58 106 0.25 3 107 7.5 75 108 1.6 16 109 1.6 16 115 0.05 1 117 0.8 8 119 4.2 42 120 2 20 121 0.1 1 122 34.6 346 123 4 40 133 2.7 27 134 0.15 2 135 2.5 25 136 0.8 8 137 0.6 6 147 0.15 2 148 1.2 12 161 6 60 162 1 10 189 0.08 1 204 2.2 22 //