ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011917
RECORD_TITLE: PHTHALIMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PHTHALIMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₅NO₂
CH$EXACT_MASS: 147.03203
CH$SMILES: C1=CC=C2C(=C1)C(=O)NC2=O
CH$IUPAC: InChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11)
CH$LINK: CAS 85-41-6
CH$LINK: NIKKAJI J4.918B
CH$LINK: INCHIKEY XKJCHHZQLQNZHY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3026514

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0ufs-9800000000-e9a94eb343ce2dbdbd59
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  18 3.5 35
  26 1.2 12
  27 1.11 11
  28 10.03 100
  32 2.33 23
  37 7.06 71
  38 7.29 73
  39 2.75 28
  43 5.53 55
  44 1.38 14
  46 1.4 14
  49 3.57 36
  50 41.55 416
  51 3.91 39
  52 2.94 29
  53 1.81 18
  59 1.21 12
  61 2.14 21
  62 2.04 20
  63 3.58 36
  64 2.71 27
  66 3.62 36
  70 1.29 13
  73 5.04 50
  74 21.79 218
  75 16.79 168
  76 84.03 840
  77 7.77 78
  90 3.33 33
  91 1.35 14
  92 1.98 20
  103 38.14 381
  104 73.14 731
  105 5.98 60
  139 1.11 11
  147 99.99 999
  148 9.49 95
//