ACCESSION: MSBNK-EPA-ENTACT_AGILENT001520
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 NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 293.1758328669
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4i-9000000000-2f36dbec2c399aa0f707
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  41.003288 5.336607 53
  57.034588 100 999
  57.070974 1.520896 15
  99.081539 6.013229 60
  121.029503 1.265457 12
//