MassBank Record: KO002459



 6-Benzylaminopurine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002459
RECORD_TITLE: 6-Benzylaminopurine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID B015

CH$NAME: 6-Benzylaminopurine CH$NAME: N-Benzyladenine CH$NAME: N6-Benzyladenine CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H11N5 CH$EXACT_MASS: 225.10145 CH$SMILES: C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3 CH$IUPAC: InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17) CH$LINK: CAS 1214-39-7 CH$LINK: KEGG C11263 CH$LINK: NIKKAJI J1.764G CH$LINK: PUBCHEM SID:13440
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 226 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-004i-2090000000-820b2c69e4f3d818f46f PK$NUM_PEAK: 52 PK$PEAK: m/z int. rel.int. 50.100 1326734.0 23 63.700 29703.0 1 67.900 74257.5 1 73.000 54455.5 1 73.900 29703.0 1 75.100 34653.5 1 80.900 79208.0 1 82.500 89109.0 2 83.100 44554.5 1 87.200 19802.0 1 89.000 44554.5 1 90.900 12678230.5 224 94.800 39604.0 1 95.900 39604.0 1 97.100 29703.0 1 98.900 49505.0 1 101.400 14851.5 1 103.000 19802.0 1 105.200 569307.5 10 106.000 361386.5 6 107.400 54455.5 1 111.000 64356.5 1 116.800 34653.5 1 117.500 19802.0 1 119.200 39604.0 1 120.400 49505.0 1 132.900 59406.0 1 133.900 693070.0 12 134.900 59406.0 1 136.200 29703.0 1 137.500 59406.0 1 139.300 24752.5 1 141.300 39604.0 1 144.300 94059.5 2 146.100 59406.0 1 148.100 470297.5 8 149.300 99010.0 2 152.000 698020.5 12 157.100 24752.5 1 165.200 29703.0 1 167.400 24752.5 1 169.100 54455.5 1 173.200 39604.0 1 176.800 39604.0 1 184.100 138614.0 2 191.400 242574.5 4 191.600 74257.5 1 194.200 44554.5 1 199.300 34653.5 1 208.500 29703.0 1 209.200 1386140.0 25 226.200 56435700.0 999 //