MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008412
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008412
RECORD_TITLE: STYRENE OXIDE; 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$NAME: STYRENE OXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H8O
CH$EXACT_MASS: 120.05751
CH$SMILES: c(c2)ccc(c2)C(C1)O1
CH$IUPAC: InChI=1S/C8H8O/c1-2-4-7(5-3-1)8-6-9-8/h1-5,8H,6H2
CH$LINK: INCHIKEY
AWMVMTVKBNGEAK-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2021286
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$SPLASH: splash10-0006-9100000000-2de812e0d003816c42f5
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
26 1.09 11
27 2.41 24
29 5.42 54
37 1.73 17
38 6.21 62
39 19.11 191
40 1.61 16
41 1.9 19
50 11.41 114
51 19.34 193
52 2.56 26
61 2.3 23
62 8.69 87
63 23.17 232
64 9.02 90
65 19.29 193
66 1.26 13
74 2.82 28
75 2.05 21
76 1.12 11
77 7.88 79
78 1.8 18
86 1.09 11
87 1.06 11
88 1.04 10
89 58.17 582
90 65.32 653
91 99.99 999
92 33.64 336
93 1.75 18
105 1.77 18
119 40.38 404
120 36.86 369
121 2.83 28
//