ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007323
RECORD_TITLE: FURFURYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: FURFURYL ALCOHOL
CH$NAME: 2-FURANMETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₆O₂
CH$EXACT_MASS: 98.03678
CH$SMILES: OCc(c1)occ1
CH$IUPAC: InChI=1S/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H2
CH$LINK: CAS 98-00-0
CH$LINK: INCHIKEY XPFVYQJUAUNWIW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2025347

AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0005-9000000000-2210e7bfe012e42016ac
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  14 2.56 26
  15 2.86 29
  25 1.36 14
  26 6.79 68
  27 24.19 242
  28 3.8 38
  29 23.71 237
  30 1.91 19
  31 14.3 143
  35 1.61 16
  36 1.06 11
  37 9.51 95
  38 16.77 168
  39 55.34 553
  40 7.13 71
  41 70.04 700
  42 39.09 391
  43 10.44 104
  44 9 90
  48.5 2.88 29
  49 2.71 27
  50 10.21 102
  51 14.67 147
  52 11.78 118
  53 45.69 457
  54 2.18 22
  55 13.52 135
  56 1.43 14
  57 1.34 13
  66 1.42 14
  67 1.27 13
  68 2.96 30
  69 31.99 320
  70 34.82 348
  71 2.07 21
  79 1.47 15
  80 1.7 17
  81 56.28 563
  82 2.98 30
  95 6.45 65
  96 1.5 15
  97 58.11 581
  98 99.99 999
  99 5.76 58
//