MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006068
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006068
RECORD_TITLE: TRIBUTYL PHOSPHATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: TRIBUTYL PHOSPHATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H27O4P
CH$EXACT_MASS: 266.16470
CH$SMILES: CCCCOP(=O)(OCCCC)OCCCC
CH$IUPAC: InChI=1S/C12H27O4P/c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3
CH$LINK: INCHIKEY
STCOOQWBFONSKY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3021986
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0002-9520000000-e39df2c0e648208c000b
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
56 1.19 12
57 2.98 30
99 99.99 999
111 1.76 18
125 5.41 54
127 1.99 20
137 3.36 34
153 1.67 17
154 1.41 14
155 37.86 379
156 1.72 17
167 2.22 22
183 1.73 17
209 0.26 3
211 24.3 243
212 2.01 20
266 0.04 0
//