MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009128
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009128
RECORD_TITLE: DIBUTYL SULFIDE; 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$NAME: DIBUTYL SULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18S
CH$EXACT_MASS: 146.11292
CH$SMILES: CCCCSCCCC
CH$IUPAC: InChI=1S/C8H18S/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3
CH$LINK: INCHIKEY
HTIRHQRTDBPHNZ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6022058
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$SPLASH: splash10-0bvi-9000000000-85df5bd2cd49cd3fbdd7
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
15 1.46 15
26 2.32 23
27 29.36 294
28 6.75 68
29 51.67 517
30 1.25 13
35 1.65 17
39 16.59 166
40 1.82 18
41 48.73 487
42 3.13 31
43 4.09 41
45 10.96 110
46 7.81 78
47 20.16 202
48 2.01 20
49 1.82 18
53 2.96 30
54 1.44 14
55 26.59 266
56 95.56 956
57 31.79 318
58 2.33 23
59 4.26 43
60 4.57 46
61 99.99 999
62 3.44 34
63 3.74 37
73 1.28 13
75 3.61 36
88 2.15 22
89 12.76 128
90 25.66 257
91 12.51 125
92 1.54 15
103 13.56 136
104 1.36 14
117 4.47 45
146 33.32 333
147 3.14 31
148 1.8 18
//