MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012234
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012234
RECORD_TITLE: 1-TETRADECENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 1-TETRADECENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H28
CH$EXACT_MASS: 196.21910
CH$SMILES: CCCCCCCCCCCCC=C
CH$IUPAC: InChI=1S/C14H28/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3H,1,4-14H2,2H3
CH$LINK: CAS
1120-36-1
CH$LINK: INCHIKEY
HFDVRLIODXPAHB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4027367
AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-01ot-9700000000-283472fd7bc74e3efa11
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
55 4.49 45
57 61.32 613
58 2.53 25
69 16.57 166
70 2.52 25
71 69.63 696
72 3.83 38
81 2.52 25
82 1.46 15
83 64.2 642
84 5.3 53
85 54.97 550
86 3.23 32
95 2.13 21
96 1.18 12
97 99.99 999
98 8.57 86
99 48.67 487
100 3.72 37
109 1.27 13
111 66.05 661
112 6.34 63
113 41.63 416
114 3.53 35
125 40.18 402
126 4.32 43
127 24.88 249
128 2.48 25
139 20.03 200
140 2.43 24
141 16.17 162
142 1.79 18
153 5.51 55
155 8.52 85
156 1.03 10
169 2.22 22
183 1.74 17
195 30.43 304
196 9.27 93
197 51.39 514
198 7.91 79
//