MassBank Record: WA002878



 2,5-Dimethoxy amphetamine; LC-ESI-Q; MS; POS; 60 V 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: WA002878
RECORD_TITLE: 2,5-Dimethoxy amphetamine; 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$NAME: 2,5-Dimethoxy amphetamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H17NO2 CH$EXACT_MASS: 195.12593 CH$SMILES: COc(c1)cc(CC([H])(C)N)c(OC)c1 CH$IUPAC: InChI=1S/C11H17NO2/c1-8(12)6-9-7-10(13-2)4-5-11(9)14-3/h4-5,7-8H,6,12H2,1-3H3/t8-/m0/s1 CH$LINK: CAS 2801-68-5 CH$LINK: INCHIKEY LATVFYDIBMDBSY-QMMMGPOBSA-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 11.200 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$SPLASH: splash10-022a-0900000000-90773447f745e3717b03 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 103 35 35 104 12 12 105 63 63 106 27 27 107 106 106 108 71 71 109 39 39 115 55 55 116 8 8 117 35 35 118 59 59 119 43 43 121 999 999 122 55 55 123 302 302 124 35 35 131 24 24 132 43 43 133 51 51 134 12 12 135 27 27 136 35 35 137 8 8 138 106 106 139 125 125 140 8 8 147 47 47 149 823 823 150 24 24 151 576 576 152 35 35 162 55 55 164 705 705 165 47 47 179 94 94 180 8 8 196 47 47 //