MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005675

2-HEXANOL; EI-B; MS

---

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005675
RECORD_TITLE: 2-HEXANOL; 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$NAME: 2-HEXANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O
CH$EXACT_MASS: 102.10447
CH$SMILES: CCCCC(C)O
CH$IUPAC: InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3
CH$LINK: INCHIKEY QNVRIHYSUZMSGM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30893088

---

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$SPLASH: splash10-0002-9000000000-4c27b69e9102343f0cba
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  27 1.24 12
  29 2.74 27
  31 1.02 10
  41 9.03 90
  42 2.55 26
  43 9.08 91
  44 7.9 79
  45 99.99 999
  46 2.62 26
  55 3.88 39
  56 4.44 44
  57 3.02 30
  69 22.91 229
  70 1.26 13
  84 9.63 96
  85 11.22 112
  87 11.26 113
  101 1.24 12
  102 0.08 1
//