ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003231
RECORD_TITLE: 3,4,5-TRIMETHYL-ISOXAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 3,4,5-TRIMETHYL-ISOXAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H9NO
CH$EXACT_MASS: 111.06841
CH$SMILES: Cc(n1)c(C)c(C)o1
CH$IUPAC: InChI=1S/C6H9NO/c1-4-5(2)7-8-6(4)3/h1-3H3
CH$LINK: INCHIKEY MGHKWBQZEBMFOH-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6E
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: splash10-0297-9200000000-a9433990cfbab223a733
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  41 8 80
  42 71 710
  43 85 850
  55 58 580
  68 85 850
  96 86 860
  110 16 160
  111 99.99 999
//
