ACCESSION: MSBNK-Waters-WA002683
RECORD_TITLE: Naphazoline; LC-ESI-Q; MS; POS; 75 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Naphazoline
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₄N₂
CH$EXACT_MASS: 210.11570
CH$SMILES: C(C3)NC(=N3)Cc(c1)c(c2)c(ccc2)cc1
CH$IUPAC: InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)
CH$LINK: CAS 835-31-4
CH$LINK: INCHIKEY CNIIGCLFLJGOGP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3048449

AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 11.080 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 75 V

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

PK$SPLASH: splash10-0006-0900000000-adc2d3708acf0cdf0d01
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  115 274 274
  116 24 24
  128 20 20
  129 12 12
  141 999 999
  142 118 118
  152 16 16
  153 27 27
  166 35 35
  167 39 39
  168 27 27
  209 12 12
  211 51 51
//