MassBank Record: KO000338



 6-Benzylaminopurine; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000338
RECORD_TITLE: 6-Benzylaminopurine; LC-ESI-QQ; MS2; CE:30 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$SMILES: c(c3)ccc(c3)CNc(n2)c(n1)c(nc2)nc1 CH$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 NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 224 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-001i-0900000000-25690980dd53487d74c8 PK$NUM_PEAK: 17 PK$PEAK: m/z int. rel.int. 59.100 99010.0 4 59.400 44554.5 2 91.800 84158.5 3 106.000 287129.0 11 118.000 34653.5 1 118.900 143564.5 5 132.300 1415843.0 54 133.100 26252501.5 999 134.800 14851.5 1 145.900 74257.5 3 152.600 24752.5 1 177.900 14851.5 1 181.800 74257.5 3 207.000 74257.5 3 208.000 103960.5 4 222.100 123762.5 5 224.300 2207923.0 84 //