MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007060
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007060
RECORD_TITLE: CINNAMYL FORMATE; 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$NAME: CINNAMYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H10O2
CH$EXACT_MASS: 162.06808
CH$SMILES: O=COCC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C10H10O2/c11-9-12-8-4-7-10-5-2-1-3-6-10/h1-7,9H,8H2/b7-4+
CH$LINK: INCHIKEY
LBHJXKYRYCUGPD-QPJJXVBHSA-N
AC$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: splash10-014i-8900000000-dc39a09b4ea9d66fbc6f
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
26 1.4 14
27 8.39 84
29 21.75 218
31 3.49 35
38 2.94 29
39 21.21 212
40 1.41 14
41 1.84 18
43 1.19 12
50 11.27 113
51 26.07 261
52 4.52 45
53 2.35 24
55 7.88 79
56 2.06 21
57 3.42 34
61 1.23 12
62 4.46 45
63 15.28 153
64 2.41 24
65 10.65 107
66 1.17 12
74 3.89 39
75 3.89 39
76 4.31 43
77 31.8 318
78 30.37 304
79 12.96 130
86 1.06 11
87 1.71 17
89 9.59 96
90 1.91 19
91 48.81 488
92 50.23 502
93 2.89 29
102 7.92 79
103 14.14 141
104 3.37 34
105 29.8 298
106 3.51 35
107 1.04 10
113 1.03 10
114 2.41 24
115 99.99 999
116 55.56 556
117 65.93 659
118 5.91 59
131 2.56 26
133 31.89 319
134 7.6 76
162 52.52 525
163 5.02 50
//