MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002570

PROPIONITRILE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002570
RECORD_TITLE: PROPIONITRILE; 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

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CH$NAME: PROPIONITRILE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₃H₅N
CH$EXACT_MASS: 55.04220
CH$SMILES: CCC#N
CH$IUPAC: InChI=1S/C3H5N/c1-2-3-4/h2H2,1H3
CH$LINK: INCHIKEY FVSKHRXBFJPNKK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1021879

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AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0fb9-9000000000-dba1aab77fa8fd55fa84
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  14 1.42 14
  15 7.35 74
  25 2.91 29
  26 21.69 217
  27 19.03 190
  28 99.99 999
  29 2.92 29
  37 1.73 17
  38 2.94 29
  39 2.68 27
  40 5.16 52
  50 1.91 19
  51 12.13 121
  52 15.1 151
  53 9.81 98
  54 86.78 868
  55 18.97 190
//