MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003584
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003584
RECORD_TITLE: TRI-PHENYL PHOSPHATE; 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$NAME: TRI-PHENYL PHOSPHATE
CH$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$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004i-9326000000-9c4393ff77260db61f29
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
27 2.54 25
39 32.89 329
47 6.72 67
50 5.25 53
51 31.62 316
63 6.3 63
64 3.59 36
65 48.18 482
66 5.71 57
76 2.31 23
77 80.48 805
78 5.46 55
93 9.24 92
94 27.02 270
95 2.32 23
115 3.7 37
139 6.33 63
140 7.75 78
141 10.34 103
142 3.83 38
151 2.11 21
152 6.34 63
153 2 20
156 2.96 30
168 12.49 125
169 18.01 180
170 32.48 325
171 3.37 34
215 19.15 192
216 2.53 25
227 2.76 28
228 12.41 124
229 5.34 53
232 12.06 121
233 23.74 237
234 3.04 30
246 3.87 39
249 4.86 49
325 70.42 704
326 99.99 999
327 20.22 202
328 2.77 28
//
system version 2.2.8-SNAPSHOT