MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005727
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005727
RECORD_TITLE: METHYL DISULFIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: METHYL DISULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2H6S2
CH$EXACT_MASS: 93.99109
CH$SMILES: CSSC
CH$IUPAC: InChI=1S/C2H6S2/c1-3-4-2/h1-2H3
CH$LINK: CAS
624-92-0
CH$LINK: INCHIKEY
WQOXQRCZOLPYPM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4025117
AC$INSTRUMENT: HITACHI M-80
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: splash10-0005-9000000000-41761824faab2335162b
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
15 25.13 251
16 0.4 4
17 0.27 3
18 1.1 11
27 0.91 9
28 6.46 65
32 8.21 82
33 2.33 23
34 0.94 9
35 0.8 8
44 7.87 79
45 99.99 999
46 45.09 451
47 32.55 326
48 13.05 131
49 4.05 41
50 0.57 6
61 16.48 165
62 0.57 6
63 0.68 7
64 16.28 163
65 0.8 8
66 1.53 15
76 0.92 9
77 0.64 6
78 3.18 32
79 56.53 565
80 2.27 23
81 5.23 52
93 0.97 10
94 95.76 958
95 4.41 44
96 8.6 86
97 0.31 3
98 0.22 2
//