MassBank Record: JP002846



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

ACCESSION: JP002846
RECORD_TITLE: 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$NAME: BETA-SANTALENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H24 CH$EXACT_MASS: 204.18780 CH$SMILES: CC(C)=CCCC(C)(C(=C)1)C(C2)CC(C2)1 CH$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-ab8503587dedec620722 PK$NUM_PEAK: 60 PK$PEAK: m/z int. rel.int. 27 5 50 28 1.1 11 29 4 40 39 0.68 7 40 1.2 12 41 28.1 281 42 1.1 11 43 0.38 4 51 1.5 15 52 1 10 53 5.6 56 54 0.06 1 55 18.5 185 56 1 10 63 0.5 5 65 0.31 3 66 1.5 15 67 10.7 107 68 1.5 15 69 0.09 1 70 0.6 6 75 0.5 5 77 10.6 106 78 0.25 3 79 19.1 191 80 1.8 18 81 4.7 47 82 0.05 1 83 7.1 71 84 0.6 6 91 11 110 92 0.31 3 93 22.5 225 94 99.99 999 95 10 100 96 0.05 1 103 0.5 5 105 4.7 47 106 2.6 26 107 0.51 5 108 0.8 8 109 0.6 6 117 0.5 5 119 0.26 3 120 2 20 121 9.6 96 122 33.3 333 123 0.37 4 133 2 20 134 1.1 11 135 1.6 16 136 0.08 1 137 0.8 8 147 1.3 13 148 0.6 6 161 0.26 3 162 0.5 5 176 0.5 5 189 0.8 8 204 0.8 8 //