ACCESSION: MSBNK-Keio_Univ-KO002857
RECORD_TITLE: Ethylamine; LC-ESI-QQ; MS2; CE:40 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$LINK: KEGG C00797
CH$LINK: NIKKAJI J1.437K
CH$LINK: PUBCHEM SID:4055
CH$LINK: INCHIKEY QUSNBJAOOMFDIB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8025678

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 40 V

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

PK$SPLASH: splash10-03fr-9100000000-bee30c9a05e01b4aad87
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  11.500 54455.5 423
  12.200 74257.5 576
  23.600 89109.0 692
  25.500 44554.5 346
  26.400 59406.0 461
  30.300 99010.0 768
  38.600 49505.0 384
  41.300 99010.0 768
  42.500 14851.5 115
  45.200 59406.0 461
  49.000 54455.5 423
  56.600 29703.0 231
  58.400 64356.5 500
  62.400 128713.0 999
  77.200 29703.0 231
  78.600 49505.0 384
  110.500 54455.5 423
  126.000 74257.5 576
  158.500 24752.5 192
  171.500 9901.0 77
  229.700 14851.5 115
  307.900 19802.0 154
  375.900 19802.0 154
  487.100 9901.0 77
//