MassBank Record: KO000623



 2'-Deoxyguanosine; LC-ESI-QQ; MS2; CE:50 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000623
RECORD_TITLE: 2'-Deoxyguanosine; LC-ESI-QQ; MS2; CE:50 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 D057

CH$NAME: 2'-Deoxyguanosine CH$NAME: Deoxyguanosine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C10H13N5O4 CH$EXACT_MASS: 267.09675 CH$SMILES: OC[C@@H](O1)[C@@H](O)C[C@@H]1n(c3)c(N=2)c(n3)C(=O)NC(N)2 CH$IUPAC: InChI=1S/C10H13N5O4/c11-10-13-8-7(9(18)14-10)12-3-15(8)6-1-4(17)5(2-16)19-6/h3-6,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5+,6+/m0/s1 CH$LINK: CAS 961-07-9 CH$LINK: CHEBI 17172 CH$LINK: KEGG C00330 CH$LINK: NIKKAJI J13.863K CH$LINK: PUBCHEM SID:3624
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 266 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0a59-3900000000-8a9725a766901535e6e3 PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 59.000 698020.5 552 60.100 39604.0 31 64.700 14851.5 12 66.100 44554.5 35 77.900 24752.5 20 78.400 54455.5 43 79.800 89109.0 71 80.400 39604.0 31 81.900 34653.5 27 90.200 24752.5 20 91.200 34653.5 27 91.700 54455.5 43 93.300 19802.0 16 95.400 19802.0 16 96.800 29703.0 24 100.200 59406.0 47 102.100 24752.5 20 105.000 94059.5 74 106.200 207921.0 165 106.900 193069.5 153 108.200 975248.5 772 124.300 19802.0 16 133.000 1262377.5 999 134.200 69307.0 55 148.500 19802.0 16 150.200 316832.0 251 176.400 24752.5 20 189.900 59406.0 47 204.900 19802.0 16 206.200 217822.0 172 //