MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008751
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008751
RECORD_TITLE: DIETHYL 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$NAME: DIETHYL SULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H10S
CH$EXACT_MASS: 90.05032
CH$SMILES: CCSCC
CH$IUPAC: InChI=1S/C4H10S/c1-3-5-4-2/h3-4H2,1-2H3
CH$LINK: INCHIKEY
LJSQFQKUNVCTIA-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5027146
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$SPLASH: splash10-004j-9000000000-87e7e650df07337181fe
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
15 2.33 23
26 13.88 139
27 75.12 751
28 13.35 134
29 49.68 497
33 1.56 16
34 5.12 51
35 16.86 169
41 8.06 81
45 28.66 287
46 19.09 191
47 81.13 811
48 2.12 21
49 3.23 32
57 3.95 40
58 12.81 128
59 15.38 154
60 12.18 122
61 57.12 571
62 50.92 509
63 3.17 32
64 2.21 22
75 99.99 999
76 2.9 29
77 3.52 35
89 2.33 23
90 68.99 690
91 2.87 29
92 2.18 22
//
system version 2.2.6-SNAPSHOT