ACCESSION: KO002858
RECORD_TITLE: Ethylamine; 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 E025

CH$NAME: Ethylamine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂H₇N
CH$EXACT_MASS: 45.05785
CH$SMILES: CCN
CH$IUPAC: InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3
CH$LINK: CAS 75-04-7
CH$LINK: CHEBI 15862
CH$LINK: COMPTOX DTXSID8025678
CH$LINK: INCHIKEY QUSNBJAOOMFDIB-UHFFFAOYSA-N
CH$LINK: KEGG C00797
CH$LINK: NIKKAJI J1.437K
CH$LINK: PUBCHEM SID:4055

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$FOCUSED_ION: PRECURSOR_M/Z 46
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+

PK$SPLASH: splash10-02di-9100000000-bd259a9e5886b3b57cab
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  14.1 69307.0 999.0
  16.0 24752.5 357.0
  16.7 59406.0 856.0
  22.0 69307.0 999.0
  23.1 14851.5 214.0
  26.1 59406.0 856.0
  27.5 34653.5 500.0
  28.6 14851.5 214.0
  32.3 64356.5 928.0
  38.6 24752.5 357.0
  41.3 19802.0 285.0
  45.7 29703.0 428.0
  56.5 19802.0 285.0
  76.1 54455.5 785.0
  78.5 59406.0 856.0
  93.6 34653.5 500.0
  110.9 64356.5 928.0
  161.9 14851.5 214.0
  170.8 24752.5 357.0
  177.1 29703.0 428.0
  218.9 49505.0 714.0
  819.4 34653.5 500.0
//

Formula		m/z