MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008396
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008396
RECORD_TITLE: ETHYL GERANYL ACETONE; 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$NAME: ETHYL GERANYL ACETONE
CH$NAME: 6,10-DIMETHYL-5,9-DODECADIEN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H24O
CH$EXACT_MASS: 208.18272
CH$SMILES: CCC(C)=CCCC(C)=CCCC(C)=O
CH$IUPAC: InChI=1S/C14H24O/c1-5-12(2)8-6-9-13(3)10-7-11-14(4)15/h8,10H,5-7,9,11H2,1-4H3/b12-8+,13-10+
CH$LINK: INCHIKEY
HSRQHSFPIKREMB-SDCOAONHSA-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$SPLASH: splash10-0006-9100000000-82e272b37dbeca6a080e
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
15 1.72 17
27 5.39 54
29 5.62 56
39 9.02 90
41 26.56 266
42 2.04 20
43 99.99 999
44 2.11 21
53 5.66 57
54 1.36 14
55 53.31 533
56 2.63 26
58 2.14 21
65 1.81 18
67 11.83 118
68 2.81 28
69 2.18 22
71 2.05 21
77 2.17 22
79 2.71 27
81 4.95 50
82 6.41 64
83 31.71 317
84 2.37 24
91 1.77 18
93 4.93 49
94 1.14 11
95 2.87 29
107 7.92 79
108 2.44 24
109 1.58 16
111 1.1 11
121 2.38 24
123 2.59 26
125 10.17 102
126 1.13 11
135 1.42 14
138 1.14 11
150 5.57 56
151 9.83 98
152 1.1 11
208 1.5 15
//