ACCESSION: MSBNK-Keio_Univ-KO001444
RECORD_TITLE: 6-Methylaminopurine; 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 M072

CH$NAME: 6-Methylaminopurine
CH$NAME: N6-Methyladenine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₇N₅
CH$EXACT_MASS: 149.07015
CH$SMILES: CNC1=NC=NC2=C1NC=N2
CH$IUPAC: InChI=1S/C6H7N5/c1-7-5-4-6(10-2-8-4)11-3-9-5/h2-3H,1H3,(H2,7,8,9,10,11)
CH$LINK: CAS 443-72-1
CH$LINK: KEGG C08434
CH$LINK: NIKKAJI J128.125I
CH$LINK: PUBCHEM SID:10629
CH$LINK: INCHIKEY CKOMXBHMKXXTNW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1020857

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$FOCUSED_ION: PRECURSOR_M/Z 148
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-

PK$SPLASH: splash10-001i-0900000000-f9139c5b6ccbec800e53
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  65.500 89109.0 4
  65.800 64356.5 3
  78.900 198020.0 8
  91.100 44554.5 2
  91.900 1168318.0 46
  104.700 54455.5 2
  106.100 1475249.0 58
  117.000 628713.5 25
  117.500 74257.5 3
  119.000 99010.0 4
  131.900 5886144.5 233
  133.000 25237649.0 999
  146.000 866337.5 34
  148.100 4638618.5 184
//