MassBank Record: MSBNK-Waters-WA002064
ACCESSION: MSBNK-Waters-WA002064
RECORD_TITLE: Metapramine; 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$NAME: Metapramine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H18N2
CH$EXACT_MASS: 238.14700
CH$SMILES: CNC(C1)c(c3)c(ccc3)N(C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C16H18N2/c1-17-14-11-12-7-3-5-9-15(12)18(2)16-10-6-4-8-13(14)16/h3-10,14,17H,11H2,1-2H3
CH$LINK: CAS
21730-16-5
CH$LINK: INCHIKEY
YXVZOBVWVRFPTE-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 13.040 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$SPLASH: splash10-0006-0900000000-9c7a709797fe86360494
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
165 67 67
166 47 47
167 121 121
168 12 12
178 20 20
179 12 12
191 20 20
192 259 259
193 999 999
194 137 137
207 20 20
208 125 125
209 16 16
//