MassBank Record: JP010692



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

ACCESSION: JP010692
RECORD_TITLE: (+)-ALPHA-CYPERONE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: EGUCHI SFAC. OF SCIENCE, HIROSHIMA UNIV., FAC. OF SCIENCE, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (+)-ALPHA-CYPERONE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H22O CH$EXACT_MASS: 218.16707 CH$SMILES: CC(=C)C([H])(C1)CC(=C(C)2)C(C)(CCC(=O)2)C1 CH$IUPAC: InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15?/m1/s1 CH$LINK: INCHIKEY KUFXJZXMWHNCEH-KEKZHRQWSA-N
AC$INSTRUMENT: HITACHI RMU-6L 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: splash10-0006-9700000000-a4f6ddf93d1ac3db8abd PK$NUM_PEAK: 97 PK$PEAK: m/z int. rel.int. 41 99.99 999 42 7.5 75 43 49 490 45 0.2 2 51 10 100 52 7 70 53 39 390 54 0.8 8 55 52 520 56 5 50 57 8 80 58 0.2 2 59 4 40 63 3 30 64 2 20 65 4 40 66 7 70 67 40 400 68 9 90 69 3.1 31 70 4 40 71 10 100 77 36 360 78 0.9 9 79 43 430 80 13 130 81 32 320 82 1.4 14 83 8 80 84 2.5 25 85 3 30 91 4.7 47 92 10 100 93 47 470 94 13 130 95 2.9 29 96 8 80 97 8 80 103 5 50 104 0.2 2 105 33.5 335 106 11 110 107 32 320 108 2.2 22 109 32 320 110 12 120 111 10 100 112 0.5 5 115 5 50 116 2 20 117 8 80 118 0.4 4 119 34 340 120 14.5 145 121 30 300 122 1.7 17 123 10.5 105 124 11 110 125 3 30 127 0.3 3 128 3 30 131 6.5 65 132 7 70 133 2.3 23 134 14 140 135 16 160 136 32.5 325 137 1.8 18 138 5 50 143 3 30 145 6 60 146 0.4 4 147 28 280 148 11 110 149 7 70 150 0.8 8 151 2 20 157 5 50 159 5 50 160 0.3 3 161 26.5 265 162 14 140 163 5 50 175 1.9 19 176 9 90 177 4 40 179 1.5 15 185 0.4 4 189 4 40 190 5 50 200 1.5 15 201 0.1 1 203 12 120 204 5 50 218 29 290 219 1.45 15 220 3 30 //