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MassBank Record: KO001929

Tryptophanamide; LC-ESI-QQ; MS2; CE:20 V; [M-H]-

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: KO001929
RECORD_TITLE: Tryptophanamide; LC-ESI-QQ; MS2; CE:20 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 T054

CH$NAME: Tryptophanamide
CH$NAME: L-Tryptophanamide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H13N3O
CH$EXACT_MASS: 203.10586
CH$SMILES: C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)N)N
CH$IUPAC: InChI=1S/C11H13N3O/c12-9(11(13)15)5-7-6-14-10-4-2-1-3-8(7)10/h1-4,6,9,14H,5,12H2,(H2,13,15)/t9-/m0/s1
CH$LINK: KEGG C00977
CH$LINK: PUBCHEM SID:4226
CH$LINK: INCHIKEY JLSKPBDKNIXMBS-VIFPVBQESA-N

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 20 V

MS$FOCUSED_ION: PRECURSOR_M/Z 202
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-

PK$SPLASH: splash10-0udi-1590000000-ce7149f21e5d190d6759
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  41.700 29703.0 1
  59.100 777228.5 32
  71.300 856436.5 35
  73.000 3099013.0 127
  116.000 79208.0 3
  129.000 6430699.5 264
  130.200 6970304.0 286
  141.900 514852.0 21
  144.600 84158.5 3
  159.200 19802.0 1
  183.900 49505.0 2
  185.200 188119.0 8
  202.200 24366361.0 999
//

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