MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008534
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008534
RECORD_TITLE: TRANS-2-NONENYL ACETATE; 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$NAME: TRANS-2-NONENYL ACETATE
CH$NAME: ACETIC ACID TRANS-2-NONENYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H20O2
CH$EXACT_MASS: 184.14633
CH$SMILES: CCCCCCC=CCOC(C)=O
CH$IUPAC: InChI=1S/C11H20O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h8-9H,3-7,10H2,1-2H3/b9-8+
CH$LINK: INCHIKEY
WFCCNPHGLLPSDJ-CMDGGOBGSA-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$SPLASH: splash10-0006-9000000000-363b5158324756197ef1
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
15 2.28 23
27 9.51 95
29 12.08 121
39 10.25 103
40 1.47 15
41 22.86 229
42 5.5 55
43 99.99 999
44 2.71 27
53 4.82 48
54 30.11 301
55 19.04 190
56 4.32 43
57 9.24 92
58 1.88 19
61 1.62 16
66 1.76 18
67 16.07 161
68 13.83 138
69 9.79 98
70 2.91 29
71 6.13 61
72 2.76 28
73 1.02 10
79 1.46 15
81 12.94 129
82 16.36 164
83 5.18 52
84 1.02 10
85 1.38 14
86 1.54 15
95 10.95 110
96 11.5 115
97 1.07 11
99 2.47 25
100 3.68 37
109 1.31 13
113 2.72 27
114 2.7 27
124 7.19 72
141 1.59 16
142 5.63 56
//