MassBank Record: KO003042



 Ganciclovir; LC-ESI-QQ; MS2; CE:40 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO003042
RECORD_TITLE: Ganciclovir; LC-ESI-QQ; MS2; CE:40 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 40 V
MS$FOCUSED_ION: PRECURSOR_M/Z 256 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0udu-2900000000-fd85740333fbb29714c8 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 44.200 24752.5 25 57.100 94059.5 94 70.100 49505.0 49 72.900 64356.5 64 74.600 9901.0 10 81.200 29703.0 30 86.800 29703.0 30 90.900 559406.5 556 93.200 54455.5 54 94.100 49505.0 49 96.900 24752.5 25 98.400 14851.5 15 104.900 89109.0 89 107.600 54455.5 54 109.000 89109.0 89 110.300 381188.5 379 117.900 24752.5 25 119.100 123762.5 123 120.600 29703.0 30 125.000 193069.5 192 126.300 19802.0 20 133.900 34653.5 34 135.200 945545.5 940 142.300 321782.5 320 148.800 29703.0 30 152.200 1004951.5 999 153.300 118812.0 118 162.800 29703.0 30 165.400 14851.5 15 //