MassBank Record: KO002612



 Ciprofloxacin; LC-ESI-QQ; MS2; CE:10 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002612
RECORD_TITLE: Ciprofloxacin; LC-ESI-QQ; MS2; CE:10 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 C133

CH$NAME: Ciprofloxacin CH$COMPOUND_CLASS: N/A CH$FORMULA: C17H18FN3O3 CH$EXACT_MASS: 331.13322 CH$SMILES: OC(=O)C(=C1)C(=O)c(c3)c(cc(N(C4)CCNC4)c(F)3)N1C(C2)C2 CH$IUPAC: InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24) CH$LINK: CAS 85721-33-1 CH$LINK: KEGG C05349 CH$LINK: NIKKAJI J21.732H CH$LINK: PUBCHEM SID:7727
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 332 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-001i-0009000000-06b6d10cecb7c9cab240 PK$NUM_PEAK: 34 PK$PEAK: m/z int. rel.int. 122.700 9901.0 1 123.800 19802.0 1 132.000 24752.5 1 150.400 24752.5 1 157.400 64356.5 2 158.400 34653.5 1 175.000 450495.5 12 176.200 94059.5 3 184.100 84158.5 2 185.300 64356.5 2 198.300 89109.0 2 213.300 19802.0 1 217.000 54455.5 1 218.300 94059.5 3 223.200 54455.5 1 225.300 39604.0 1 229.800 39604.0 1 233.400 74257.5 2 233.900 19802.0 1 241.000 133663.5 4 245.500 29703.0 1 254.500 99010.0 3 256.000 79208.0 2 259.600 138614.0 4 268.100 19802.0 1 272.200 153465.5 4 288.400 89109.0 2 296.300 14851.5 1 297.400 39604.0 1 298.500 9901.0 1 300.400 99010.0 3 314.500 222772.5 6 315.600 4252479.5 114 332.600 37410928.5 999 //