MassBank Record: MSBNK-Waters-WA000238
ACCESSION: MSBNK-Waters-WA000238
RECORD_TITLE: Haloxyfop; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Haloxyfop
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H11ClF3NO4
CH$EXACT_MASS: 361.03287
CH$SMILES: OC(=O)C(C)Oc(c2)ccc(c2)Oc(n1)c(Cl)cc(c1)C(F)(F)F
CH$IUPAC: InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)
CH$LINK: CAS
69806-34-4
CH$LINK: INCHIKEY
GOCUAJYOYBLQRH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7042019
AC$INSTRUMENT: QuattroPremier XE, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QQ
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40 V
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 362
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-0006-9270000000-1da07b3813baee20c167
PK$NUM_PEAK: 48
PK$PEAK: m/z int. rel.int.
55 12 12
63 12 12
65 188 188
69 8 8
73 12 12
75 55 55
76 16 16
81 20 20
91 999 999
92 133 133
94 24 24
107 8 8
109 27 27
119 59 59
121 51 51
139 12 12
141 8 8
155 8 8
159 8 8
175 20 20
178 12 12
180 59 59
182 16 16
189 12 12
190 8 8
192 8 8
198 24 24
203 20 20
206 20 20
209 86 86
216 51 51
218 16 16
219 20 20
222 12 12
224 12 12
226 51 51
232 31 31
235 16 16
237 39 39
245 20 20
252 27 27
254 20 20
261 27 27
270 8 8
272 345 345
273 12 12
288 321 321
289 16 16
//
system version 2.2.6-SNAPSHOT