MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008519
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008519
RECORD_TITLE: METHYL CINNAMATE; 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$NAME: METHYL CINNAMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H10O2
CH$EXACT_MASS: 162.06808
CH$SMILES: COC(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+
CH$LINK: INCHIKEY
CCRCUPLGCSFEDV-BQYQJAHWSA-N
CH$LINK: COMPTOX
DTXSID5044314
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$SPLASH: splash10-0w30-4900000000-7f967019a24723339f54
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
15 6.57 66
26 1.03 10
27 2.15 22
29 4.64 46
30 1.14 11
38 1.53 15
39 3.68 37
50 10.84 108
51 28.22 282
52 3.49 35
53 1.35 14
59 1.4 14
62 2.11 21
63 6.22 62
65 1.48 15
74 4.58 46
75 6 60
76 7.23 72
77 44.73 447
78 3.66 37
85 1.16 12
91 3.76 38
101 1.58 16
102 16.8 168
103 61.84 618
104 8.04 80
105 1 10
117 2.4 24
121 1.43 14
130 1.87 19
131 99.99 999
132 10.07 101
147 1.38 14
161 18.63 186
162 49.6 496
163 5.41 54
//