MassBank Record: KO002183



 Amantadine; 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: KO002183
RECORD_TITLE: Amantadine; 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 A061

CH$NAME: 1-Adamantanamine CH$NAME: Amantadine CH$COMPOUND_CLASS: Non-Natural Product CH$FORMULA: C10H17N CH$EXACT_MASS: 151.13610 CH$SMILES: NC(C3)(C1)CC(C2)CC(CC23)1 CH$IUPAC: InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2 CH$LINK: CAS 768-94-5 CH$LINK: CHEBI 2618 CH$LINK: KEGG C06818 CH$LINK: NIKKAJI J6.971J CH$LINK: PUBCHEM SID:9036
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 152 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0udi-0900000000-1a8aac6647f0187ebdf9 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 44.700 24752.5 1 59.000 1103961.5 2 73.000 5133668.5 10 77.200 207921.0 1 81.300 24752.5 1 83.900 29703.0 1 88.200 2797032.5 5 89.100 4693074.0 9 91.100 94059.5 1 92.400 39604.0 1 93.300 34653.5 1 95.100 9901.0 1 98.900 123762.5 1 105.900 64356.5 1 107.100 227723.0 1 116.200 64356.5 1 117.000 5856441.5 11 120.100 965347.5 2 134.100 89109.0 1 135.100 163584322.0 308 152.300 530267857.0 999 170.200 59406.0 1 265.200 9901.0 1 //