MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000736

2,2,5-TRIMETHYL-3-OXA-5-HEXEN-1-OL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000736
RECORD_TITLE: 2,2,5-TRIMETHYL-3-OXA-5-HEXEN-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

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CH$NAME: 2,2,5-TRIMETHYL-3-OXA-5-HEXEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₆O₂
CH$EXACT_MASS: 144.11503
CH$SMILES: OCC(C)(C)OCC(C)=C
CH$IUPAC: InChI=1S/C8H16O2/c1-7(2)5-10-8(3,4)6-9/h9H,1,5-6H2,2-4H3
CH$LINK: INCHIKEY VIYJKNBZRRVSLZ-UHFFFAOYSA-N

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AC$INSTRUMENT: HITACHI RMS-4
AC$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$SPLASH: splash10-0a4i-9100000000-e4a22138ac868e3704d8
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
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  42 4 40
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//