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MassBank Record: MSBNK-EPA-ENTACT_AGILENT002141

2,5,8,11,14-Pentaoxapentadecane; ESI-QTOF; MS2; CE: 10; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT002141
RECORD_TITLE: 2,5,8,11,14-Pentaoxapentadecane; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2,5,8,11,14-Pentaoxapentadecane
CH$NAME: DTXSID7044396
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H22O5
CH$EXACT_MASS: 222.1467238133
CH$SMILES: COCCOCCOCCOCCOC
CH$IUPAC: InChI=1S/C10H22O5/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2/h3-10H2,1-2H3
CH$LINK: CAS 143-24-8
CH$LINK: INCHIKEY ZUHZGEOKBKGPSW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8925

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 223.154000265
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0pb9-9600000000-01b1c0d48b61e928b843
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  31.017841 1.072231 10
  45.033491 2.989071 29
  59.049141 99.999998 999
  59.085527 1.927302 19
  89.059706 2.510068 25
  103.075356 69.070023 690
  133.085921 1.137639 11
  147.101571 5.334148 53
//

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