ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003770
RECORD_TITLE: 4-(3-(4-(3-HYDROXYBUTOXY)PHENOXY)PROPYL)MORPHOLINE; 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$NAME: 4-(3-(4-(3-HYDROXYBUTOXY)PHENOXY)PROPYL)MORPHOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₇NO₄
CH$EXACT_MASS: 309.19401
CH$SMILES: CC(O)CCOc(c1)ccc(OCCCN(C2)CCOC2)c1
CH$IUPAC: InChI=1S/C17H27NO4/c1-15(19)7-12-22-17-5-3-16(4-6-17)21-11-2-8-18-9-13-20-14-10-18/h3-6,15,19H,2,7-14H2,1H3
CH$LINK: INCHIKEY RVXDPUFIEQVQMR-UHFFFAOYSA-N

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$SPLASH: splash10-03di-0219000000-9ccfd800ffe6888b434a
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  61 2.75 28
  63 2.67 27
  67 1.39 14
  70 3.57 36
  71 0.96 10
  73 1.38 14
  81 0.83 8
  100 8.58 86
  128 19.66 197
  238 0.61 6
  280 1.91 19
  282 10.79 108
  283 1.82 18
  284 2.35 24
  292 3.8 38
  308 3.33 33
  310 99.99 999
  311 17 170
  312 1.94 19
//