MassBank Record: KO000611



 2'-Deoxycytidine; 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: KO000611
RECORD_TITLE: 2'-Deoxycytidine; 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 D055

CH$NAME: 2'-Deoxycytidine CH$NAME: Deoxycytidine CH$COMPOUND_CLASS: Natural Product CH$FORMULA: C9H13N3O4 CH$EXACT_MASS: 227.09061 CH$SMILES: OC[C@@H](O1)[C@@H](O)C[C@@H]1N(C=2)C(=O)N=C(N)C2 CH$IUPAC: InChI=1S/C9H13N3O4/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)/t5-,6+,8+/m0/s1 CH$LINK: CAS 951-77-9 CH$LINK: CHEBI 15698 CH$LINK: CHEMPDB DCZ CH$LINK: KEGG C00881 CH$LINK: NIKKAJI J14.406A CH$LINK: PUBCHEM SID:4137
AC$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$FOCUSED_ION: PRECURSOR_M/Z 226 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0006-9200000000-297a4fef750eac4c8d96 PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 42.000 1306932.0 183 59.200 64356.5 9 65.900 415842.0 58 66.900 14851.5 2 93.100 7133670.5 999 93.900 89109.0 12 97.100 34653.5 5 104.200 19802.0 3 106.400 59406.0 8 110.000 297030.0 42 128.300 84158.5 12 131.900 356436.0 50 132.800 133663.5 19 135.200 584159.0 82 144.600 39604.0 6 148.700 49505.0 7 149.900 34653.5 5 160.800 123762.5 17 162.300 49505.0 7 175.200 762377.0 107 176.600 29703.0 4 189.100 69307.0 10 190.200 34653.5 5 226.300 89109.0 12 280.600 153465.5 21 //