MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005755
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005755
RECORD_TITLE: TRIDECANE; 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$NAME: TRIDECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H28
CH$EXACT_MASS: 184.21910
CH$SMILES: CCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3
CH$LINK: CAS
629-50-5
CH$LINK: INCHIKEY
IIYFAKIEWZDVMP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6027266
AC$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 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0596-9000000000-562483fea4bbcff9f5aa
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
39 4.82 48
40 1.46 15
41 40.61 406
42 9.32 93
43 99.99 999
44 3.74 37
53 2.05 21
54 2.26 23
55 19.09 191
56 10.29 103
57 96.92 969
58 4.17 42
67 1.52 15
68 1.32 13
69 8.09 81
70 12.2 122
71 58.38 584
72 3.39 34
82 0.97 10
83 3.05 31
84 7.07 71
85 33.34 333
97 1.48 15
98 4.91 49
99 6.54 65
111 0.33 3
112 3.23 32
113 4.77 48
126 1.94 19
127 3.63 36
140 0.91 9
141 2.16 22
154 0.58 6
155 1.08 11
184 4.66 47
185 0.73 7
//