MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008705
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008705
RECORD_TITLE: CINNAMALDEHYDE; 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$NAME: CINNAMALDEHYDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H8O
CH$EXACT_MASS: 132.05751
CH$SMILES: O=CC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
CH$LINK: INCHIKEY
KJPRLNWUNMBNBZ-QPJJXVBHSA-N
CH$LINK: COMPTOX
DTXSID6024834
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$SPLASH: splash10-0ugi-8900000000-14f14e29c81360ebdd4b
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
15 1.32 13
26 2.7 27
27 6.45 65
29 10.28 103
37 1.88 19
38 3.99 40
39 10.49 105
49 1.43 14
50 19.29 193
51 48.35 484
52 9.56 96
53 2.34 23
54 1.5 15
55 1.17 12
61 2.1 21
62 5.18 52
63 10.12 101
64 1.38 14
65 1.79 18
66 1.46 15
73 1.56 16
74 8.84 88
75 7.79 78
76 8.05 81
77 54.98 550
78 43.29 433
79 2.33 23
87 1.26 13
89 1.66 17
91 2.36 24
101 1.71 17
102 10.82 108
103 63.66 637
104 35.15 352
105 3.84 38
130 1.54 15
131 99.99 999
132 75.18 752
133 6.36 64
//