ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003777
RECORD_TITLE: 2-(3-HYDROXYBUTOXY)-N-(2-(DIETHYLAMINO)ETHYL)-3-PYRIDINECARBOXAMIDE; CI-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$LINK: INCHIKEY NPSIJBTYSVKEIW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:101618151

AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-01p9-9004000000-a521e42fb344c07ec353
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  71 1.86 19
  73 1.52 15
  85 2.36 24
  86 99.99 999
  87 3.98 40
  99 27.48 275
  100 4.96 50
  237 4.12 41
  308 2.32 23
  310 52.96 530
  311 8.25 83
//