MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004685

1-IODOOCTANE; EI-B; MS

---

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004685
RECORD_TITLE: 1-IODOOCTANE; EI-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$NAME: 1-IODOOCTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₇I
CH$EXACT_MASS: 240.03749
CH$SMILES: CCCCCCCCI
CH$IUPAC: InChI=1S/C8H17I/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
CH$LINK: CAS 629-27-6
CH$LINK: INCHIKEY UWLHSHAHTBJTBA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4060868

---

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-05fu-9100000000-442b8708e7e2a2d2acfd
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  42 22.2 222
  43 44.73 447
  44 4.57 46
  53 1.17 12
  55 8.84 88
  56 1.81 18
  57 93.4 934
  58 4.67 47
  69 2.29 23
  71 99.99 999
  72 6.2 62
  84 1.09 11
  85 2.88 29
  113 26.82 268
  114 2.78 28
  141 1.27 13
  155 8.99 90
  169 1.22 12
  183 1.2 12
  240 13.15 132
  241 1.32 13
//