MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008319
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008319
RECORD_TITLE: DI-TERT-BUTYL PEROXIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA
CH$NAME: DI-TERT-BUTYL PEROXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H18O2
CH$EXACT_MASS: 146.13068
CH$SMILES: CC(C)(C)OOC(C)(C)C
CH$IUPAC: InChI=1S/C8H18O2/c1-7(2,3)9-10-8(4,5)6/h1-6H3
CH$LINK: COMPTOX
DTXSID2024955
CH$LINK: INCHIKEY
LSXWFXONGKSEMY-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:8033
AC$INSTRUMENT: HITACHI M-60
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: splash10-0a4l-9000000000-6e5db1e17bcdf366f700
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
14 5.13 51
15 36.89 369
16 1.44 14
26 2.48 25
27 7.59 76
29 15.15 152
31 2.98 30
37 0.55 6
38 1.04 10
39 4.59 46
40 0.51 5
41 22.64 226
42 6.11 61
43 82.33 823
44 1.92 19
45 2.9 29
55 2.02 20
56 3.41 34
57 99.99 999
58 22.55 226
59 5.06 51
73 7.57 76
146 4.34 43
147 0.25 3
//