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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000217

Diisobutyldithiophosphinic acid; ESI-QTOF; MS2; CE: 20; [M-H]-

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000217
RECORD_TITLE: Diisobutyldithiophosphinic acid; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Diisobutyldithiophosphinic acid
CH$NAME: DTXSID9044798
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H19PS2
CH$EXACT_MASS: 210.0665785561
CH$SMILES: CC(C)CP(S)(=S)CC(C)C
CH$IUPAC: InChI=1S/C8H19PS2/c1-7(2)5-9(10,11)6-8(3)4/h7-8H,5-6H2,1-4H3,(H,10,11)
CH$LINK: CAS 13360-80-0
CH$LINK: INCHIKEY PTZADPBANVYSTR-UHFFFAOYSA-N

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 209.0593021044
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0006-9130000000-36363ec3a250d2e97657
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  32.980444 1.17294 11
  94.918452 100.000005 999
  119.008981 2.663427 26
  151.988877 13.525334 135
  209.059302 33.92509 338
//

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