MassBank Record: KO003041



 Ganciclovir; 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: KO003041
RECORD_TITLE: Ganciclovir; 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 G088

CH$NAME: Ganciclovir CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H13N5O4 CH$EXACT_MASS: 255.09675 CH$SMILES: OCC(CO)OCn(c2)c(N=1)c(n2)C(=O)NC(N)1 CH$IUPAC: InChI=1S/C9H13N5O4/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-5(1-15)2-16/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17) CH$LINK: KEGG C07019
AC$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 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 256 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0udi-1900000000-2eca31ed3c60988970dc PK$NUM_PEAK: 43 PK$PEAK: m/z int. rel.int. 59.000 34653.5 11 68.900 29703.0 10 69.600 14851.5 5 72.900 49505.0 16 81.100 59406.0 20 83.300 29703.0 10 84.900 24752.5 8 87.300 79208.0 26 88.300 29703.0 10 91.000 366337.0 121 96.900 34653.5 11 104.900 113861.5 37 109.200 49505.0 16 110.200 94059.5 31 111.200 34653.5 11 117.000 19802.0 7 119.200 232673.5 77 121.800 19802.0 7 122.400 39604.0 13 123.300 19802.0 7 125.100 133663.5 44 132.700 24752.5 8 135.000 297030.0 98 136.900 49505.0 16 137.700 39604.0 13 138.900 24752.5 8 142.200 381188.5 125 148.100 440594.5 145 150.100 29703.0 10 151.100 89109.0 29 152.300 3034656.5 999 163.000 79208.0 26 164.900 29703.0 10 168.900 19802.0 7 178.500 89109.0 29 182.900 39604.0 13 198.500 158416.0 52 207.200 69307.0 23 220.700 103960.5 34 238.000 29703.0 10 246.700 29703.0 10 247.100 14851.5 5 256.600 84158.5 28 //