MassBank Record: MSBNK-Waters-WA000237
ACCESSION: MSBNK-Waters-WA000237
RECORD_TITLE: Haloxyfop; LC-ESI-QQ; MS2; CE:30 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 30 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: splash10-0006-9260000000-013cf65d43d31215fe6a
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
55 8 8
65 59 59
72 8 8
91 999 999
92 90 90
109 12 12
119 145 145
121 106 106
198 20 20
206 8 8
209 8 8
219 20 20
226 12 12
232 16 16
235 8 8
245 12 12
247 31 31
249 8 8
252 16 16
253 8 8
260 31 31
270 12 12
272 259 259
273 12 12
288 313 313
290 67 67
316 67 67
//
system version 2.2.6-SNAPSHOT