MassBank MassBank Search Contents Download

MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010914

TRANS-2-HEXENYL PHENYLACETATE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010914
RECORD_TITLE: TRANS-2-HEXENYL PHENYLACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: TRANS-2-HEXENYL PHENYLACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C14H18O2
CH$EXACT_MASS: 218.13068
CH$SMILES: CCCC=CCOC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h4-10H,2-3,11-12H2,1H3/b8-4+
CH$LINK: INCHIKEY BYGAPGDXGHDYGP-XBXARRHUSA-N
CH$LINK: COMPTOX DTXSID90887180

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9000000000-791ebfdd24937a736821
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 9 90
  29 4.5 45
  39 14.4 144
  41 38.4 384
  42 3.1 31
  43 1.8 18
  50 1.4 14
  51 2.9 29
  52 1.4 14
  53 3.4 34
  54 6.1 61
  55 49.8 498
  56 2.5 25
  57 1.3 13
  63 2.5 25
  65 13.8 138
  66 1.2 12
  67 10.3 103
  77 1.2 12
  79 1 10
  81 1.7 17
  82 6.7 67
  83 31.9 319
  84 1.8 18
  89 3 30
  90 2.1 21
  91 99.99 999
  92 12.1 121
  99 1.3 13
  118 3.5 35
  119 1.1 11
  218 4.9 49
//

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