MassBank Record: JP002845



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

ACCESSION: JP002845
RECORD_TITLE: ALPHA-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$NAME: ALPHA-SANTALENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H24 CH$EXACT_MASS: 204.18780 CH$SMILES: CC(C)=CCCC(C)(C32)C(C)(C(C3)1)C(C2)1 CH$IUPAC: InChI=1S/C15H24/c1-10(2)6-5-7-14(3)11-8-12-13(9-11)15(12,14)4/h6,11-13H,5,7-9H2,1-4H3
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: splash10-0006-9300000000-ff99a56466c488e3c3f8 PK$NUM_PEAK: 83 PK$PEAK: m/z int. rel.int. 26 0.5 5 27 10 100 28 4 40 29 1.15 12 39 13.5 135 40 2.1 21 41 60.5 605 42 0.28 3 43 15 150 45 1.5 15 50 0.6 6 51 0.35 4 52 1.6 16 53 12.5 125 54 1.3 13 55 2.57 26 56 2.6 26 57 2.2 22 63 1 10 64 0.01 0 65 8 80 66 4 40 67 15 150 68 0.22 2 69 41.5 415 70 3.5 35 71 0.8 8 75 0.11 1 77 22.5 225 78 5.1 51 79 31 310 80 0.04 0 81 8.5 85 82 8 80 83 2.8 28 89 0.12 1 90 0.8 8 91 29.7 297 92 8.6 86 93 0.85 9 94 99.99 999 95 48 480 96 5.1 51 97 0.01 0 103 2 20 104 1.1 11 105 21.1 211 106 0.75 8 107 34.3 343 108 14.5 145 109 11 110 110 0.18 2 115 1.1 11 116 0.6 6 117 1.8 18 118 0.05 1 119 16.1 161 120 12 120 121 39 390 122 2.25 23 123 4 40 129 0.5 5 131 0.8 8 133 0.85 9 134 4.3 43 135 7 70 136 2.5 25 137 0.61 6 138 1 10 147 2.5 25 148 4 40 149 0.25 3 150 0.5 5 161 10.5 105 162 1.5 15 163 0.05 1 175 1.3 13 176 3.1 31 177 0.5 5 189 0.11 1 190 1.8 18 204 17.5 175 205 3 30 //