MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009120
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009120
RECORD_TITLE: TRICOSANE; 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$NAME: TRICOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C23H48
CH$EXACT_MASS: 324.37560
CH$SMILES: CCCCCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C23H48/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3
CH$LINK: CAS
638-67-5
CH$LINK: INCHIKEY
FIGVVZUWCLSUEI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7047699
AC$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-b55658471f93057544d6
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
27 5.96 60
29 17.99 180
39 2.42 24
41 32.66 327
42 9.52 95
43 91.28 913
44 1.99 20
53 1.29 13
54 2.13 21
55 26.13 261
56 14.33 143
57 99.99 999
58 3.33 33
67 1.79 18
68 1.98 20
69 13.86 139
70 10.44 104
71 58.87 589
72 2.76 28
82 1.53 15
83 8.68 87
84 5.23 52
85 36.96 370
86 1.71 17
97 5.72 57
98 3 30
99 10.68 107
111 1.88 19
112 2.23 22
113 5.74 57
126 1.51 15
127 3.41 34
140 1.5 15
141 2.4 24
154 1.16 12
155 1.82 18
169 1.6 16
183 1.09 11
197 1.04 10
//