MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008215
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008215
RECORD_TITLE: (2E,6Z)-2,6-NONADIENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: (2E,6Z)-2,6-NONADIENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H16O
CH$EXACT_MASS: 140.12012
CH$SMILES: CCC([H])=C([H])CCC([H])=C([H])CO
CH$IUPAC: InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-8,10H,2,5-6,9H2,1H3/b4-3+,8-7-
CH$LINK: INCHIKEY
AMXYRHBJZOVHOL-UTUPVWNLSA-N
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00kf-9000000000-22d780c57d4454901ece
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
39 2.94 29
40 0.88 9
41 99.99 999
42 12.06 121
43 48.53 485
53 9.12 91
54 45.59 456
55 27.94 279
56 3.24 32
57 17.35 174
66 3.24 32
67 30.89 309
68 64.71 647
69 70.59 706
70 17.94 179
71 6.18 62
77 1.76 18
78 3.82 38
79 22.94 229
80 10.59 106
81 9.41 94
82 2.94 29
83 2.94 29
84 0.88 9
85 2.94 29
91 1.18 12
93 22.35 224
94 8.24 82
95 0.88 9
96 1.18 12
97 4.41 44
107 5.89 59
109 14.12 141
111 1.76 18
122 5.29 53
//
system version 2.2.6-SNAPSHOT