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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006042

TRIPROPYLENE GLYCOL MONOMETHYL ETHER; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006042
RECORD_TITLE: TRIPROPYLENE GLYCOL MONOMETHYL ETHER; 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$NAME: TRIPROPYLENE GLYCOL MONOMETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H22O4
CH$EXACT_MASS: 206.15181
CH$SMILES: OCCCOCCCOCCCOC
CH$IUPAC: InChI=1S/C10H22O4/c1-12-6-3-8-14-10-4-9-13-7-2-5-11/h11H,2-10H2,1H3
CH$LINK: INCHIKEY GRTBNOKQBKPUGM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00157003

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$SPLASH: splash10-0avi-9600000000-28d7830d3bb40d2862ad
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  31 5.33 53
  41 7.11 71
  42 1.08 11
  43 1.89 19
  45 13.27 133
  47 1.53 15
  57 5.29 53
  58 4.49 45
  59 99.99 999
  60 5.66 57
  72 12.9 129
  73 73.74 737
  74 3.48 35
  85 1.36 14
  87 1.85 19
  99 2.58 26
  103 38.25 383
  104 2.57 26
  117 74.69 747
  118 5.28 53
  130 3.47 35
  132 5.41 54
  161 31.78 318
  162 3.18 32
  206 0.86 9
  207 0.09 1
//

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