ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003465
RECORD_TITLE: 2-(3-HYDROXYBUTOXY)-N-(2-(DIETHYLAMINO)ETHYL)-3-PYRIDINECARBOXAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2-(3-HYDROXYBUTOXY)-N-(2-(DIETHYLAMINO)ETHYL)-3-PYRIDINECARBOXAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H27N3O3
CH$EXACT_MASS: 309.20524
CH$SMILES: CCN(CC)CCNC(=O)c(c1)c(OCCC(C)O)ncc1
CH$IUPAC: InChI=1S/C16H27N3O3/c1-4-19(5-2)11-10-17-15(21)14-7-6-9-18-16(14)22-12-8-13(3)20/h6-7,9,13,20H,4-5,8,10-12H2,1-3H3,(H,17,21)
CH$LINK: INCHIKEY NPSIJBTYSVKEIW-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000i-9000000000-761b9655861b6d4c946f
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  43 0.24 2
  56 0.37 4
  58 2.43 24
  70 0.31 3
  71 1.88 19
  72 0.75 8
  84 1.12 11
  85 0.57 6
  86 99.99 999
  87 7.98 80
  95 0.22 2
  96 0.12 1
  99 16 160
  100 1.22 12
  113 0.35 4
  121 0.14 1
  122 1 10
  165 1.05 11
  211 0.26 3
  221 0.35 4
  237 0.74 7
  238 0.22 2
  294 0.17 2
//
