ACCESSION: MSBNK-RIKEN_ReSpect-PT203620
RECORD_TITLE: Hyp, (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid, Hypro, trans-4-Hydroxy-L-proline, (2S,4R)-4-Hydroxypyrrolidine-2-carboxylic acid, Oxaceprol; LC-ESI-QTOF; MS2
DATE: 2008.07.28
AUTHORS: Matsuda F, Suzuki M, Sawada Y, Plant Science Center, RIKEN.
LICENSE: CC BY-NC
COPYRIGHT: Copyright(C) 2009 Plant Science Center, RIKEN
COMMENT: Build 1 2009/06/24
COMMENT: Acquisition and generation of the data is financially supported in part by CREST/JST.

CH$NAME: Hyp
CH$NAME: (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid
CH$NAME: Hypro
CH$NAME: trans-4-Hydroxy-L-proline
CH$NAME: (2S,4R)-4-Hydroxypyrrolidine-2-carboxylic acid
CH$NAME: Oxaceprol
CH$COMPOUND_CLASS: CLASS1 Amino acid CLASS2 Proline
CH$FORMULA: C₅H₉NO₃
CH$EXACT_MASS: 131.131
CH$SMILES: C1C(CNC1C(=O)O)O
CH$IUPAC: InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)
CH$LINK: CAS 51-35-4
CH$LINK: INCHIKEY PMMYEEVYMWASQN-UHFFFAOYSA-N

AC$INSTRUMENT: Q-Tof Premier, Waters
AC$INSTRUMENT_TYPE: LC-ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY Ramp 5-45 V
AC$MASS_SPECTROMETRY: CAPILLARY_VOLTAGE 3.0 kV
AC$CHROMATOGRAPHY: SOLVENT CH3CN/H2O

MS$FOCUSED_ION: ION_TYPE [M-H]-
MS$FOCUSED_ION: PRECURSOR_M/Z 130.05044

PK$SPLASH: splash10-001i-0900000000-11800ca52c6e911f8313
PK$NUM_PEAK: 4
PK$PEAK: m/z int. rel.int.
  71.0155 14.94 43
  84.0463 15.56 45
  128.0353 121.0 349
  130.0504 345.9 999
//