MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007689
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007689
RECORD_TITLE: PENTADECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KYOTO INSTITUTE OF TECHNOLOGY
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$LINK: CAS
629-62-9
CH$LINK: INCHIKEY
YCOZIPAWZNQLMR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6027268
AC$INSTRUMENT: SHIMADZU QP-1000
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-9000000000-02e5634c0c5383d948e0
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
40 2.8 28
41 44.4 444
42 12.2 122
43 99.99 999
44 4.1 41
53 1.5 15
54 1.7 17
55 1.66 17
56 13.9 139
57 97.8 978
58 4.4 44
67 0.12 1
68 1 10
69 6.2 62
70 8.6 86
71 5.01 50
72 2.7 27
82 1.1 11
83 3.2 32
84 0.45 5
85 27.6 276
86 1.9 19
97 2 20
98 0.29 3
99 6.5 65
111 0.7 7
112 1.9 19
113 0.27 3
126 1.2 12
127 1.5 15
140 0.8 8
141 0.11 1
154 0.5 5
155 0.8 8
168 0.2 2
169 0.05 1
182 0.1 1
183 0.2 2
212 0.8 8
213 0.2 2
//
system version 2.2.8-SNAPSHOT