MassBank Record: JP004078



 ALPHA-METHYL-3-PHENOXYBENZYLALCOHOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP004078
RECORD_TITLE: ALPHA-METHYL-3-PHENOXYBENZYLALCOHOL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO MDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: ALPHA-METHYL-3-PHENOXYBENZYLALCOHOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H14O2 CH$EXACT_MASS: 214.09938 CH$SMILES: CC(O)c(c2)cc(cc2)Oc(c1)cccc1 CH$IUPAC: InChI=1S/C14H14O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11,15H,1H3 CH$LINK: INCHIKEY MYWBBBSIAHHXJK-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6E 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: splash10-01ox-9420000000-3fad2214685973a233c8 PK$NUM_PEAK: 88 PK$PEAK: m/z int. rel.int. 37 1 10 38 5.1 51 39 31 310 40 5.5 55 41 4.2 42 43 98 980 44 2.6 26 45 1.6 16 50 16 160 51 55 550 52 6.8 68 53 0.32 3 55 4.1 41 62 2.7 27 63 11 110 64 0.57 6 65 71 710 66 12 120 67 1.1 11 74 0.35 4 75 5.5 55 76 9 90 77 66 660 78 1.5 15 89 2.7 27 90 1 10 90.5 2.5 25 91 1 10 92 2.5 25 93 71 710 94 23 230 95 0.38 4 98 2.7 27 98.5 1.3 13 99 9 90 99.5 1.5 15 102 2.4 24 103 4.3 43 104 2.3 23 105 0.38 4 106 1.5 15 107 1.2 12 115 10.5 105 116 0.15 2 119 1.1 11 120 1.2 12 121 6.8 68 122 0.09 1 127 1.5 15 128 4.3 43 129 1.3 13 139 0.33 3 140 1 10 141 11 110 142 3 30 143 0.17 2 149 1.3 13 151 1.9 19 152 8.1 81 153 3.5 35 154 5.1 51 157 1.3 13 159 1 10 165 0.14 1 167 1.4 14 168 2.3 23 169 5.2 52 170 0.47 5 171 88 880 172 12 120 173 1 10 181 0.58 6 182 1 10 185 2.5 25 186 3.6 36 187 0.19 2 195 2.7 27 196 2.1 21 197 6 60 198 0.22 2 199 54 540 200 8.3 83 201 0.9 9 202 0.08 1 213 2.4 24 214 99.99 999 215 16 160 216 1.6 16 //