ACCESSION: MSBNK-Waters-WA000132
RECORD_TITLE: Ferimzone Z; 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$NAME: Ferimzone Z
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₈N₄
CH$EXACT_MASS: 254.15315
CH$SMILES: CC(=C1)NC(=NN=C(C)c(c2)c(C)ccc2)N=C(C)1
CH$IUPAC: InChI=1S/C15H18N4/c1-10-7-5-6-8-14(10)13(4)18-19-15-16-11(2)9-12(3)17-15/h5-9H,1-4H3,(H,16,17,19)/b18-13-
CH$LINK: CAS 89269-64-7
CH$LINK: INCHIKEY GOWLARCWZRESHU-AQTBWJFISA-N
CH$LINK: COMPTOX DTXSID1058210

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 255.14
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-0006-9300000000-4d944c089fb3d6e07a9a
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  54 8 8
  65 188 188
  66 39 39
  80 24 24
  82 59 59
  83 12 12
  91 999 999
  92 16 16
  94 31 31
  95 231 231
  105 24 24
  107 98 98
  115 24 24
  117 192 192
  118 8 8
  122 12 12
  123 196 196
  130 16 16
  132 47 47
//