MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006070
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006070
RECORD_TITLE: TRIPHENYL 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$NAME: TRIPHENYL PHOSPHATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H15O4P
CH$EXACT_MASS: 326.07080
CH$SMILES: c(c3)ccc(c3)OP(=O)(Oc(c2)cccc2)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
CH$LINK: INCHIKEY
XZZNDPSIHUTMOC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1021952
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$SPLASH: splash10-004i-0129000000-bbf93f1986ed8ada7490
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
77 2.05 21
93 1.3 13
94 5.86 59
95 1.06 11
140 1 10
141 1.19 12
142 1.05 11
168 1.17 12
169 6.1 61
170 14.04 140
171 2.2 22
215 7 70
216 1.11 11
227 1.14 11
228 6.86 69
229 3.45 35
232 7.04 70
233 14.05 141
234 2.05 21
246 2.22 22
249 2.81 28
325 51.87 519
326 99.99 999
327 18.77 188
328 2.62 26
//