ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009167
RECORD_TITLE: 2-FORMYLTHIOPHENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 2-FORMYLTHIOPHENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₄OS
CH$EXACT_MASS: 111.99829
CH$SMILES: O=Cc(c1)scc1
CH$IUPAC: InChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4H
CH$LINK: COMPTOX DTXSID7052656
CH$LINK: INCHIKEY CNUDBTRUORMMPA-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7364

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-03di-7900000000-d6371ed8fe6f2eccb3cc
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  26 2.11 21
  29 8.68 87
  32 1.27 13
  37 6.5 65
  38 9.33 93
  39 35.18 352
  40 1.53 15
  42 1.31 13
  44 1.37 14
  45 22.82 228
  49 2.56 26
  50 6.31 63
  51 2.57 26
  53 2.2 22
  56 1.09 11
  57 16.35 164
  58 14.16 142
  69 3.49 35
  81 6.09 61
  82 5.44 54
  83 11.66 117
  84 4.13 41
  111 99.99 999
  112 93.95 940
  113 10.71 107
  114 4.43 44
//