ACCESSION: MSBNK-EPA-ENTACT_AGILENT001365
RECORD_TITLE: N,N'-Disalicylidene-1,2-diaminopropane; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N'-Disalicylidene-1,2-diaminopropane
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₁₈N₂O₂
CH$EXACT_MASS: 282.1368278336
CH$SMILES: CC(C/N=C/C1=CC=CC=C1O)/N=C/C1=CC=CC=C1O
CH$IUPAC: InChI=1S/C17H18N2O2/c1-13(19-12-15-7-3-5-9-17(15)21)10-18-11-14-6-2-4-8-16(14)20/h2-9,11-13,20-21H,10H2,1H3/b18-11+,19-12+
CH$LINK: CAS 94-91-7
CH$LINK: INCHIKEY RURPJGZXBHYNEM-GDAWTGGTSA-N
CH$LINK: PUBCHEM CID:5359281

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$FOCUSED_ION: PRECURSOR_M/Z 283.1441042853
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-03dj-1920000000-f8b3c31a6a78519261fc
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  44.049476 6.656103 66
  56.049476 10.727487 107
  58.065126 11.425953 114
  77.038577 1.246621 12
  91.054227 1.137971 11
  107.049141 19.944182 199
  115.054227 1.35077 13
  117.069877 2.919732 29
  121.064791 3.224833 32
  122.06004 11.189593 111
  127.054227 1.317189 13
  134.06004 1.304924 13
  135.080441 2.450187 24
  145.064791 94.25415 941
  145.10973 3.157585 31
  145.13354 1.598261 15
  147.067865 1.209067 12
  148.07569 3.075128 30
  149.083515 1.417061 14
  162.09134 99.999995 999
  162.140302 3.451327 34
  177.102239 3.721411 37
  183.080441 2.585248 25
  209.059706 6.919673 69
  211.075356 3.096508 30
  224.070605 4.009104 40
  226.086255 8.888312 88
  240.101905 1.862285 18
  266.117555 2.673225 26
  283.144104 38.567232 385
//