MassBank Record: KO001028



 Harman; 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: KO001028
RECORD_TITLE: Harman; 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 H029

CH$NAME: Harman CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H10N2 CH$EXACT_MASS: 182.08440 CH$SMILES: CC1=NC=CC2=C1NC3=CC=CC=C23 CH$IUPAC: InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3 CH$LINK: CAS 486-84-0 CH$LINK: KEGG C09209 CH$LINK: NIKKAJI J1.550D CH$LINK: PUBCHEM SID:11400
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 181 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-001i-0900000000-2c091f7fb293a5702807 PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 42.000 44554.5 8 45.200 19802.0 4 59.300 237624.0 43 72.800 19802.0 4 92.800 108911.0 20 99.100 222772.5 40 120.900 123762.5 22 122.900 34653.5 6 129.400 24752.5 4 136.900 39604.0 7 141.500 79208.0 14 151.300 113861.5 21 181.300 5529708.5 999 //