MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003292

NITROSOPIPERIDINE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003292
RECORD_TITLE: NITROSOPIPERIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

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CH$NAME: NITROSOPIPERIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₀N₂O
CH$EXACT_MASS: 114.07931
CH$SMILES: O=NN(C1)CCCC1
CH$IUPAC: InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2
CH$LINK: INCHIKEY UWSDONTXWQOZFN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021060

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AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-0a4i-9100000000-d4d06a856b940bcb0461
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  51 3.29 33
  52 2.64 26
  53 8.36 84
  54 16.62 166
  55 99.99 999
  56 44.19 442
  57 5.88 59
  67 4.2 42
  68 2.21 22
  69 2.1 21
  82 3.93 39
  83 4.1 41
  84 4.85 49
  114 26.71 267
  115 1.8 18
//