ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007747
RECORD_TITLE: ALLYL 2-FUROATE; 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$NAME: ALLYL 2-FUROATE
CH$NAME: 2-FURANCARBOXYLIC ACID 2-PROPENYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₈O₃
CH$EXACT_MASS: 152.04734
CH$SMILES: C=CCOC(=O)c(c1)occ1
CH$IUPAC: InChI=1S/C8H8O3/c1-2-5-11-8(9)7-4-3-6-10-7/h2-4,6H,1,5H2
CH$LINK: CAS 4208-49-5
CH$LINK: INCHIKEY SJRQTHAMRUOPBJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6063353

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$SPLASH: splash10-0002-9200000000-0a49295e1de60a5daa89
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 1.01 10
  40 4.72 47
  41 44.16 442
  42 2.99 30
  57 21.11 211
  59 2.67 27
  66 3.85 39
  67 7.42 74
  68 30.2 302
  69 1.78 18
  78 3.04 30
  79 25.36 254
  80 11.06 111
  95 99.99 999
  96 25.41 254
  97 3.83 38
  107 7.62 76
  108 21.2 212
  112 6.36 64
  113 3.18 32
  123 15.9 159
  124 4.24 42
  152 31.81 318
  153 4.14 41
//