MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000772

3,7-DIMETHYLTROPOLONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000772
RECORD_TITLE: 3,7-DIMETHYLTROPOLONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ITO S, DEPT. OF CHEM., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: 3,7-DIMETHYLTROPOLONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀O₂
CH$EXACT_MASS: 150.06808
CH$SMILES: CC(C=1)=C(O)C(=O)C(C)=CC1
CH$IUPAC: InChI=1S/C9H10O2/c1-6-4-3-5-7(2)9(11)8(6)10/h3-5H,1-2H3,(H,10,11)
CH$LINK: INCHIKEY XWUQRGGMMROJDR-UHFFFAOYSA-N

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0udi-4900000000-7d1729e147c86f5dde32
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
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  52 6.5 65
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  63 3.5 35
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//