ACCESSION: MSBNK-Waters-WA000112
RECORD_TITLE: Naproanilide; LC-ESI-QQ; MS2; CE:10 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$NAME: Naproanilide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₁₇NO₂
CH$EXACT_MASS: 291.12593
CH$SMILES: O=C(Nc(c3)cccc3)C(C)Oc(c1)cc(c2)c(ccc2)c1
CH$IUPAC: InChI=1S/C19H17NO2/c1-14(19(21)20-17-9-3-2-4-10-17)22-18-12-11-15-7-5-6-8-16(15)13-18/h2-14H,1H3,(H,20,21)
CH$LINK: CAS 52570-16-8
CH$LINK: INCHIKEY LVKTWOXHRYGDMM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8058118

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 10 V

MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$FOCUSED_ION: PRECURSOR_M/Z 292.2
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5

PK$SPLASH: splash10-006x-1950000000-a29c5f0c86e784f88f11
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  93 321 321
  120 157 157
  128 12 12
  144 12 12
  148 114 114
  149 12 12
  171 999 999
  172 27 27
  199 157 157
  292 944 944
  293 47 47
//