MassBank Record: KO002038



 Adenosine; LC-ESI-QQ; MS2; CE:10 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002038
RECORD_TITLE: Adenosine; LC-ESI-QQ; MS2; CE:10 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 A007

CH$NAME: Adenosine CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H13N5O4 CH$EXACT_MASS: 267.09675 CH$SMILES: OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2 CH$IUPAC: InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1 CH$LINK: CAS 58-61-7 CH$LINK: CHEBI 16335 CH$LINK: CHEMPDB ADN CH$LINK: KEGG C00212 CH$LINK: NIKKAJI J4.501B CH$LINK: PUBCHEM SID:3512
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 268 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-014i-0090000000-106e7131507fadd4befb PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 45.700 19802.0 1 74.000 1490100.5 11 77.300 29703.0 1 82.200 34653.5 1 106.200 39604.0 1 121.000 103960.5 1 136.000 11064367.5 81 137.800 1668318.5 12 147.600 34653.5 1 149.800 49505.0 1 152.900 49505.0 1 156.900 24752.5 1 163.400 9901.0 1 169.700 24752.5 1 176.000 39604.0 1 177.500 69307.0 1 178.900 9901.0 1 191.400 34653.5 1 192.200 59406.0 1 195.300 252475.5 2 196.800 9901.0 1 204.700 44554.5 1 207.900 806931.5 6 214.700 19802.0 1 218.100 128713.0 1 218.700 49505.0 1 233.700 69307.0 1 236.200 74257.5 1 251.400 1856437.5 14 268.300 136267463.0 999 //