MassBank Record: WA002857



 4-Methylthioamphetamine; LC-ESI-Q; MS; POS; 60 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002857
RECORD_TITLE: 4-Methylthioamphetamine; LC-ESI-Q; MS; POS; 60 V
DATE: 2016.01.19 (2007.08.01, 2011.05.06)
AUTHORS: , Nihon Waters K.K.
LICENSE: CC BY-NC

CH$NAME: 4-Methylthioamphetamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H15NS CH$EXACT_MASS: 181.09252 CH$SMILES: CC(N)Cc(c1)ccc(SC)c1 CH$IUPAC: InChI=1S/C10H15NS/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3 CH$LINK: CAS 14116-06-4 CH$LINK: INCHIKEY OLEWMKVPSUCNLG-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 11.900 min AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C AC$CHROMATOGRAPHY: SAMPLING_CONE 60 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-014r-0900000000-f472a7a34f7964f9344e PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 103 20 20 104 16 16 105 24 24 107 43 43 109 16 16 115 286 286 117 999 999 118 204 204 119 12 12 122 165 165 123 20 20 124 59 59 125 8 8 135 204 204 137 674 674 138 51 51 139 31 31 149 20 20 150 145 145 151 12 12 165 86 86 166 12 12 182 12 12 //