MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006877
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006877
RECORD_TITLE: UNDECANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: UNDECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H24
CH$EXACT_MASS: 156.18780
CH$SMILES: CCCCCCCCCCC
CH$IUPAC: InChI=1S/C11H24/c1-3-5-7-9-11-10-8-6-4-2/h3-11H2,1-2H3
CH$LINK: INCHIKEY
RSJKGSCJYJTIGS-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9021689
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$SPLASH: splash10-052f-9000000000-f805eba4b3f7bc1e0ad7
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
27 20.5 205
28 3.82 38
29 33.83 338
39 9.44 94
40 1.28 13
41 45.96 460
42 13.32 133
43 99.99 999
44 3.16 32
53 2.24 22
54 1.49 15
55 15.86 159
56 15.52 155
57 94.31 943
58 4.39 44
69 2.97 30
70 10.24 102
71 41.55 416
72 1.5 15
83 1.1 11
84 5.56 56
85 20.14 201
98 3.48 35
99 3.22 32
112 2.02 20
113 2.3 23
127 1.6 16
156 3.38 34
//