MassBank Record: JP006309



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

ACCESSION: JP006309
RECORD_TITLE: FILIFOLIDE A; 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$NAME: FILIFOLIDE A CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H14O2 CH$EXACT_MASS: 166.09938 CH$SMILES: CC(=C1)C([H])(O2)CC([H])(C(=O)2)C(C)(C)1 CH$IUPAC: InChI=1S/C10H14O2/c1-6-5-10(2,3)7-4-8(6)12-9(7)11/h5,7-8H,4H2,1-3H3/t7-,8-/m0/s1 CH$LINK: INCHIKEY JHKNAYGQYUKKDQ-YUMQZZPRSA-N
AC$INSTRUMENT: HITACHI RMS-4 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: splash10-0a4l-9700000000-67a4efc9877d11e0a66a PK$NUM_PEAK: 48 PK$PEAK: m/z int. rel.int. 40 5.2 52 41 33.1 331 42 4.7 47 43 0.67 7 44 1 10 45 1.5 15 50 5 50 51 0.95 10 52 4.3 43 53 11.2 112 54 2.3 23 55 0.93 9 62 1.3 13 63 3.8 38 64 1.2 12 65 1.05 11 66 2.7 27 67 7.7 77 68 1.3 13 69 0.43 4 70 2.7 27 77 12.2 122 78 4.7 47 79 0.15 2 80 2.7 27 81 2.8 28 82 1.8 18 83 0.2 2 91 40.5 405 92 6.5 65 93 4.7 47 94 0.18 2 95 3.5 35 96 1.2 12 98 3.2 32 105 1.5 15 106 2.7 27 107 99.99 999 108 11.2 112 109 0.23 2 111 2 20 121 2.8 28 122 20 200 123 0.53 5 138 1 10 151 1.2 12 166 5.2 52 167 1.8 18 //