ACCESSION: MSBNK-EPA-ENTACT_AGILENT002290
RECORD_TITLE: 4-Dodecylmorpholine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-Dodecylmorpholine
CH$NAME: DTXSID4042171
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₃NO
CH$EXACT_MASS: 255.2562146824
CH$SMILES: CCCCCCCCCCCCN1CCOCC1
CH$IUPAC: InChI=1S/C16H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18-16-14-17/h2-16H2,1H3
CH$LINK: CAS 1541-81-7
CH$LINK: INCHIKEY ZRIILUSQBDFVNY-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:73764

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 256.2634911341
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4i-2090000000-9089dd368295e863a98a
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  43.054227 4.263204 42
  44.049476 1.172974 11
  57.069877 6.230229 62
  70.065126 3.512033 35
  71.085527 2.769976 27
  88.07569 13.355788 133
  102.09134 1.257295 12
  256.263491 99.999995 999
//