MassBank Record: KO002707



 2'-Deoxyguanosine; 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: KO002707
RECORD_TITLE: 2'-Deoxyguanosine; 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 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 POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 268 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0udi-0940000000-fe3943fe094f79531ea7 PK$NUM_PEAK: 35 PK$PEAK: m/z int. rel.int. 59.200 103960.5 9 73.000 49505.0 4 73.700 252475.5 23 86.100 9901.0 1 91.900 143564.5 13 93.400 59406.0 5 99.100 108911.0 10 101.900 9901.0 1 107.900 351485.5 32 109.400 89109.0 8 112.400 69307.0 6 117.200 1188120.0 107 119.800 39604.0 4 121.300 59406.0 5 134.100 44554.5 4 135.200 103960.5 9 136.000 158416.0 14 137.400 69307.0 6 148.700 89109.0 8 152.200 11138625.0 999 155.900 202970.5 18 157.200 574258.0 52 158.000 4445549.0 399 175.100 103960.5 9 177.500 74257.5 7 178.000 49505.0 4 192.400 242574.5 22 194.100 24752.5 2 195.200 311881.5 28 206.000 34653.5 3 208.300 44554.5 4 233.000 59406.0 5 250.000 198020.0 18 251.400 10257436.0 920 268.400 69307.0 6 //