ACCESSION: MSBNK-EPA-ENTACT_AGILENT001521
RECORD_TITLE: (6)-Gingerol; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: (6)-Gingerol
CH$NAME: DTXSID3041035
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₆O₄
CH$EXACT_MASS: 294.1831093186
CH$SMILES: CCCCCC(O)CC(=O)CCC1C=CC(O)=C(C=1)OC
CH$IUPAC: InChI=1S/C17H26O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h8,10-11,14,18,20H,3-7,9,12H2,1-2H3
CH$LINK: CAS 23513-14-6
CH$LINK: INCHIKEY NLDDIKRKFXEWBK-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:442793

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 295.1903857703
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-000i-3900000000-d6c0e7d738e6750a83ae
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  41.038577 1.869501 18
  43.017841 3.423253 34
  43.054227 1.980159 19
  55.017841 2.630882 26
  55.054227 4.02131 40
  56.025666 1.140954 11
  58.062446 1.204921 12
  66.046402 1.788129 17
  67.054227 1.392983 13
  69.069877 1.447566 14
  73.028406 1.067445 10
  77.038577 1.236345 12
  79.054227 2.074576 20
  81.069877 3.697574 36
  91.054227 5.589501 55
  94.041316 16.033228 160
  99.044056 2.132578 21
  101.02332 1.421391 14
  105.069877 1.336435 13
  107.049141 1.577602 15
  109.028406 1.269535 12
  115.054227 4.109991 41
  116.062052 1.084218 10
  117.069877 6.829091 68
  122.036231 28.813176 287
  137.059706 100.000002 999
  137.096091 1.401562 14
  145.064791 6.410332 64
  162.067531 1.998222 19
//