ACCESSION: MSBNK-Waters-WA001564
RECORD_TITLE: Femcamfamine; LC-ESI-Q; MS; POS; 45 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: Femcamfamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₂₁N
CH$EXACT_MASS: 215.16740
CH$SMILES: CCNC(C21)C(c(c3)cccc3)C(CC2)C1
CH$IUPAC: InChI=1S/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3
CH$LINK: CAS 1209-98-9
CH$LINK: INCHIKEY IKFBPFGUINLYQI-UHFFFAOYSA-N

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 12.880 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 45 V

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

PK$SPLASH: splash10-016r-0940000000-4a9406c9c8d6dd5bcc20
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  105 94 94
  106 8 8
  115 35 35
  117 129 129
  129 999 999
  130 86 86
  143 235 235
  144 24 24
  171 443 443
  172 51 51
  216 983 983
  217 141 141
  218 12 12
//