MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009118
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009118
RECORD_TITLE: HENICOSANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: HENICOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C21H44
CH$EXACT_MASS: 296.34430
CH$SMILES: CCCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3
CH$LINK: CAS
629-94-7
CH$LINK: INCHIKEY
FNAZRRHPUDJQCJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9047097
AC$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: splash10-0a4l-9000000000-e59f7d9328ef554ce284
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
27 6.4 64
29 18.42 184
39 3.87 39
41 36.32 363
42 9.47 95
43 87.01 870
44 2.51 25
53 1.25 13
54 2.23 22
55 26.74 267
56 13.48 135
57 99.99 999
58 3.82 38
67 2.23 22
68 2 20
69 12.38 124
70 10.71 107
71 58.26 583
72 2.95 30
82 1.33 13
83 7.88 79
84 6.01 60
85 39 390
86 1.95 20
97 4.95 50
98 3.75 38
99 10.03 100
111 1.85 19
112 2.48 25
113 5.12 51
126 1.73 17
127 3.27 33
140 1.15 12
141 2.6 26
155 1.7 17
169 1.6 16
183 1 10
296 1.11 11
//
system version 2.2.6-SNAPSHOT