ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009714
RECORD_TITLE: N,N-DIETHYLNICOTINAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: N,N-DIETHYLNICOTINAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄N₂O
CH$EXACT_MASS: 178.11061
CH$SMILES: CCN(CC)C(=O)c(c1)cncc1
CH$IUPAC: InChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3
CH$LINK: INCHIKEY NCYVXEGFNDZQCU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9046524

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0a6r-0900000000-c3bbf6b50c49f1db0682
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  72 3.32 33
  78 16.32 163
  79 1.61 16
  106 99.99 999
  107 7.69 77
  135 1.5 15
  149 6.4 64
  150 1.12 11
  163 5.01 50
  177 45.31 453
  178 23.52 235
  179 2.41 24
//