ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005416
RECORD_TITLE: 3-METHYL-1-PENTYN-3-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 3-METHYL-1-PENTYN-3-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H10O
CH$EXACT_MASS: 98.07316
CH$SMILES: CCC(C)(O)C#C
CH$IUPAC: InChI=1S/C6H10O/c1-4-6(3,7)5-2/h1,7H,5H2,2-3H3
CH$LINK: INCHIKEY QXLPXWSKPNOQLE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021756
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-014i-9000000000-d08636da239511cea4f5
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  27 5.86 59
  29 7.42 74
  31 2.19 22
  39 6.95 70
  41 3.91 39
  43 32.58 326
  50 1.64 16
  51 2.58 26
  53 5.63 56
  55 8.13 81
  68 2.19 22
  69 99.99 999
  70 4.69 47
  79 2.66 27
  81 3.75 38
  83 23.44 234
  84 1.48 15
  98 1.56 16
//
