MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007349
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007349
RECORD_TITLE: METHYL 3-PHENYL-2-PROPENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL 3-PHENYL-2-PROPENOATE
CH$NAME: CINNAMIC ACID METHYL ESTER
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: CAS
103-26-4
CH$LINK: INCHIKEY
CCRCUPLGCSFEDV-BQYQJAHWSA-N
CH$LINK: COMPTOX
DTXSID5044314
AC$INSTRUMENT: ESCO EMD-05A
AC$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$SPLASH: splash10-0gx0-3900000000-64e823d4736fb7be4e9e
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
38 2.4 24
39 3.13 31
50 9 90
51 14.7 147
52 3.04 30
53 1.46 15
59 1.33 13
62 3.94 39
63 4.63 46
74 8.36 84
75 6.17 62
76 5.4 54
77 42.05 421
78 6.13 61
85 3.21 32
91 5.36 54
92 1.33 13
94 1.5 15
101 1.89 19
102 14.66 147
103 64.08 641
104 9.94 99
105 1.84 18
115 3.04 30
117 2.31 23
121 1.97 20
130 1.46 15
131 99.99 999
132 11.49 115
137 1.33 13
161 19.16 192
162 50.45 505
163 4.97 50
//