ACCESSION: MSBNK-EPA-ENTACT_AGILENT002390
RECORD_TITLE: N,N-Diethyldodecanamide; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N-Diethyldodecanamide
CH$NAME: DTXSID5044655
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₃NO
CH$EXACT_MASS: 255.2562146824
CH$SMILES: CCCCCCCCCCCC(=O)N(CC)CC
CH$IUPAC: InChI=1S/C16H33NO/c1-4-7-8-9-10-11-12-13-14-15-16(18)17(5-2)6-3/h4-15H2,1-3H3
CH$LINK: CAS 3352-87-2
CH$LINK: INCHIKEY CWNSVVHTTQBGQB-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:18783

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

PK$SPLASH: splash10-0596-9000000000-92adf1a1ae9e4d254143
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  29.038577 1.337297 13
  41.038577 36.135682 360
  43.054227 100.000002 999
  44.01309 4.342222 43
  44.049476 4.623225 46
  45.033491 1.128937 11
  46.065126 18.511945 184
  55.054227 11.559877 115
  56.049476 1.986127 19
  57.033491 2.22313 22
  57.069877 61.899739 618
  58.065126 5.847251 58
  67.054227 4.923125 49
  69.069877 3.643997 36
  71.085527 5.669831 56
  72.04439 7.911397 79
  72.080776 3.663818 36
  74.096426 78.063047 779
  81.069877 3.468841 34
  83.085527 1.160222 11
  95.085527 2.999578 29
  100.07569 2.893417 28
  102.09134 1.7279 17
  116.10699 1.844884 18
  128.10699 2.320179 23
  130.122641 1.133522 11
  256.263491 1.03131 10
//