MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008581
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008581
RECORD_TITLE: DIPHENYLMETHANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: DIPHENYLMETHANOL
CH$NAME: DIPHENYL CARBINOL
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 M-80B
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-7900000000-79eb32b1737e049f0afe
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
14 2.62 26
27 2.52 25
32 4.39 44
39 4.64 46
50 4.74 47
51 17.1 171
52 3.64 36
53 1.19 12
63 2.01 20
75 1.21 12
76 1.85 19
77 47.27 473
78 34.5 345
79 26.67 267
105 99.99 999
106 9.24 92
107 11.34 113
152 2.54 25
155 1.54 15
165 8.7 87
166 2.55 26
167 3.05 31
182 1.3 13
183 14.6 146
184 30.94 309
185 5.02 50
//
system version 2.2.6-SNAPSHOT