MassBank Record: KO002898



 Fenfluramine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002898
RECORD_TITLE: Fenfluramine; LC-ESI-QQ; MS2; CE:50 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 F016

CH$NAME: Fenfluramine CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H16F3N CH$EXACT_MASS: 231.12348 CH$SMILES: CCNC(C)Cc(c1)cc(cc1)C(F)(F)F CH$IUPAC: InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3 CH$LINK: CAS 458-24-2 CH$LINK: KEGG C06996 CH$LINK: NIKKAJI J5.760F CH$LINK: PUBCHEM SID:9209
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 232 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0aor-9400000000-98167d6254e10b1cb5fe PK$NUM_PEAK: 19 PK$PEAK: m/z int. rel.int. 41.100 19802.0 111 43.100 84158.5 472 55.000 79208.0 444 58.200 39604.0 222 67.300 178218.0 999 68.800 49505.0 278 70.400 44554.5 250 77.000 69307.0 389 77.800 19802.0 111 79.200 29703.0 167 81.300 34653.5 194 82.300 19802.0 111 90.900 54455.5 305 95.300 64356.5 361 98.200 44554.5 250 109.000 138614.0 777 109.500 99010.0 555 121.100 19802.0 111 159.200 113861.5 638 //