ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005467
RECORD_TITLE: N-TERT-BUTOXYCARBONYL-2-(1-AZIDO-4-HYDROXYBUTYL)PYRROLIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HIRAMA M, TOHOKU UNIV. FACULTY OF SCIENCE DEPT. OF CHEMISTRY YUKIBUNSEKI
LICENSE: CC BY-NC-SA

CH$NAME: N-TERT-BUTOXYCARBONYL-2-(1-AZIDO-4-HYDROXYBUTYL)PYRROLIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₂₄N₄O₃
CH$EXACT_MASS: 284.18484
CH$SMILES: OCCCC(N=[N+1]=[N-1])C(C1)N(CC1)C(=O)OC(C)(C)C
CH$IUPAC: InChI=1S/C13H24N4O3/c1-13(2,3)20-12(19)17-8-4-7-11(17)10(15-16-14)6-5-9-18/h10-11,18H,4-9H2,1-3H3
CH$LINK: INCHIKEY FRSVVFYJSIKWHH-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 14 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-03di-1900000000-f815649cc46e9e7fd53e
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  56 1.6 16
  57 6.1 61
  58 0.9 9
  70 3.07 31
  71 4.4 44
  96 2.4 24
  114 99.99 999
  115 0.89 9
  140 2.1 21
  155 9.5 95
  170 22.7 227
  171 0.49 5
  230 3 30
  240 3 30
  284 1.4 14
//