MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005391
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005391
RECORD_TITLE: CINNAMYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: CINNAMYL ALCOHOL
CH$NAME: 3-PHENYL-2-PROPEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: OCC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+
CH$LINK: INCHIKEY
OOCCDEMITAIZTP-QPJJXVBHSA-N
AC$INSTRUMENT: SHIMADZU QP-1000
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001l-6900000000-44b04269b7d35e886fb9
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
44 2.5 25
45 2.4 24
46 7.4 74
55 0.67 7
56 3.7 37
57 1.6 16
58 1.6 16
59 0.17 2
72 1.8 18
73 1.7 17
77 2.2 22
78 2.91 29
79 7.1 71
87 3 30
88 1.5 15
89 0.59 6
91 33.9 339
92 73.4 734
93 5.8 58
102 0.13 1
103 7.1 71
105 33.6 336
106 5.2 52
107 0.2 2
114 2.5 25
115 15.9 159
116 11.5 115
117 0.68 7
118 1.4 14
119 1.4 14
131 2.3 23
132 0.31 3
133 25.9 259
134 99.99 999
135 9.9 99
177 1.2 12
//