MassBank MassBank Search Contents Download

MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001816

4-METHYL-2-PENTANOL; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001816
RECORD_TITLE: 4-METHYL-2-PENTANOL; 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$NAME: 4-METHYL-2-PENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14O
CH$EXACT_MASS: 102.10447
CH$SMILES: CC(C)CC(C)O
CH$IUPAC: InChI=1S/C6H14O/c1-5(2)4-6(3)7/h5-7H,4H2,1-3H3
CH$LINK: INCHIKEY WVYWICLMDOOCFB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2026781

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$SPLASH: splash10-0002-9000000000-249727e6c8ac064ea5fc
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  15 1.98 20
  19 1.35 14
  27 7.54 75
  29 5.08 51
  31 1.75 18
  39 5.95 60
  41 14.84 148
  42 4.76 48
  43 22.14 221
  44 6.59 66
  45 99.99 999
  46 2.22 22
  55 1.83 18
  56 4.44 44
  57 4.76 48
  69 14.29 143
  84 3.1 31
  87 4.6 46
//

Imprint Feedback
system version 2.2.7

Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium

Responsible: Hannes Bohring

Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.

de.NBI logo
EAWAG logo
fnr logo
IPB logo
NORMAN logo
UFZ logo
LCSB logo
HBM4EU logo
nfdi4chem logo