MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005935
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005935
RECORD_TITLE: PENTADECANE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: PENTADECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H32
CH$EXACT_MASS: 212.25040
CH$SMILES: CCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3
CH$LINK: INCHIKEY
YCOZIPAWZNQLMR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6027268
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-00dr-9310000000-1f5cf48a39fb43b9e383
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
70 12.52 125
71 99.99 999
73 8.06 81
82 2.42 24
84 9.18 92
85 75.21 752
86 6.81 68
94 5.16 52
97 5.06 51
98 7.78 78
99 23.34 233
100 2.47 25
111 1.58 16
112 7.43 74
113 20.72 207
114 2.45 25
125 1.46 15
126 6.95 70
127 16.37 164
128 1.3 13
138 4.4 44
139 1.99 20
140 5.23 52
141 13.45 135
142 1.8 18
154 3.1 31
155 10.18 102
168 2.23 22
169 6.74 67
183 3.57 36
211 3.38 34
212 24.35 244
213 3.42 34
//