MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000995
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000995
RECORD_TITLE: BENZHYDROL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: BENZHYDROL
CH$NAME: DI-PHENYLMETHYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H12O
CH$EXACT_MASS: 184.08882
CH$SMILES: c(c2)ccc(c2)C(O)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H12O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H
CH$LINK: INCHIKEY
QILSFLSDHQAZET-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2059015
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-0a6r-6900000000-22e1ecfc67526e625625
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
27 1.46 15
39 2.48 25
50 2.63 26
51 11.09 111
52 2.19 22
63 1.82 18
75 1.46 15
76 2.19 22
77 35.77 358
78 43.72 437
79 25.55 256
82 1.61 16
82.5 2.19 22
83 1.61 16
105 99.99 999
106 10.22 102
107 12.63 126
115 1.17 12
152 2.92 29
153 1.46 15
155 1.61 16
165 7.59 76
166 2.55 26
167 3.5 35
168 1.46 15
182 1.09 11
183 15.55 156
184 29.49 295
185 3.65 37
//
system version 2.2.6-SNAPSHOT