MassBank Record: JP002839



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

ACCESSION: JP002839
RECORD_TITLE: BETA-HIMACHALENE; 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$NAME: BETA-HIMACHALENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H24 CH$EXACT_MASS: 204.18780 CH$SMILES: CC(C2)=C([H])C([H])(C(C2)=1)C(C)(C)CCCC(C)1 CH$IUPAC: InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,14H,5-9H2,1-4H3/t14-/m0/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: splash10-014l-5910000000-a93dd80541877ea6cfd2 PK$NUM_PEAK: 93 PK$PEAK: m/z int. rel.int. 26 0.5 5 27 6 60 29 7.7 77 40 0.1 1 41 29 290 42 2 20 43 6 60 50 0.05 1 51 2.6 26 52 1.2 12 53 7.7 77 54 0.08 1 55 19.6 196 56 6.2 62 57 2.5 25 63 0.11 1 64 1 10 65 6 60 66 1.1 11 67 0.46 5 68 1 10 69 12.5 125 70 2.5 25 71 0.05 1 75 0.8 8 76 0.8 8 77 16.1 161 78 0.41 4 79 13.7 137 80 2.5 25 81 6.5 65 82 0.71 7 83 4.6 46 84 1 10 89 1 10 90 0.06 1 91 30.5 305 92 13.3 133 93 35 350 94 0.62 6 95 3.5 35 96 0.8 8 97 1 10 102 0.06 1 103 3.5 35 104 2 20 105 35.5 355 106 1.18 12 107 16.8 168 108 5.2 52 109 6 60 110 0.08 1 115 5 50 116 2 20 117 68 680 118 0.27 3 119 99.99 999 120 13.6 136 121 44.6 446 122 1.05 11 123 1 10 127 1 10 128 2.7 27 129 0.23 2 130 1.3 13 131 4.6 46 132 2.3 23 133 3.18 32 134 42 420 135 12.7 127 136 1.5 15 141 0.06 1 142 0.6 6 143 1 10 144 0.5 5 145 0.26 3 146 1.2 12 147 20.2 202 148 11.5 115 149 0.16 2 157 0.5 5 159 1 10 161 15 150 162 0.23 2 175 0.6 6 187 0.6 6 189 7.5 75 190 0.11 1 202 0.5 5 203 0.8 8 204 53 530 205 0.87 9 206 0.8 8 //