MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001288

3,6-DIOXAOCTANE-1-OL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001288
RECORD_TITLE: 3,6-DIOXAOCTANE-1-OL; 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

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CH$NAME: 3,6-DIOXAOCTANE-1-OL
CH$NAME: DIETHYLENE GLYCOL MONOETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O₃
CH$EXACT_MASS: 134.09429
CH$SMILES: CCOCCOCCO
CH$IUPAC: InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY XXJWXESWEXIICW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2021941

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0002-9000000000-571a681a0c459379a0c7
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 3.47 35
  19 3.91 39
  27 9.33 93
  28 4.1 41
  29 17.28 173
  31 34.87 349
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//