MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006881
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006881
RECORD_TITLE: TETRADECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: TETRADECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H30
CH$EXACT_MASS: 198.23475
CH$SMILES: CCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
CH$LINK: INCHIKEY
BGHCVCJVXZWKCC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1027267
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$SPLASH: splash10-052f-9000000000-358738bddc4a0cb69ad1
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
27 12.54 125
29 29.64 296
32 1.38 14
39 6.12 61
41 50.89 509
42 10.81 108
43 99.64 996
44 2.29 23
53 1.79 18
54 2.25 23
55 21.85 219
56 13.55 136
57 99.99 999
58 3.76 38
67 1.23 12
68 1.66 17
69 5.42 54
70 9.29 93
71 53.02 530
72 2.53 25
83 3.36 34
84 5.17 52
85 31.88 319
86 1.62 16
97 1.52 15
98 2.57 26
99 5.73 57
112 2.22 22
113 3.34 33
126 1.72 17
127 2.05 21
140 1.04 10
141 1.52 15
155 1.06 11
198 3.05 31
//