MassBank Record: JP000460



 3,5-DIMETHYLISOXAZOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000460
RECORD_TITLE: 3,5-DIMETHYLISOXAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 3,5-DIMETHYLISOXAZOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H7NO CH$EXACT_MASS: 97.05276 CH$SMILES: Cc(n1)cc(C)o1 CH$IUPAC: InChI=1S/C5H7NO/c1-4-3-5(2)7-6-4/h3H,1-2H3
AC$INSTRUMENT: MX-1303 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000x-9000000000-1d1d0a93bc42a51e96fa PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 26 11.5 115 27 28.6 286 29 5.2 52 30 0.38 4 37 3.6 36 38 8 80 39 27.8 278 40 0.91 9 41 14.8 148 42 19.9 199 43 72.5 725 50 0.3 3 51 6.3 63 52 8.8 88 53 4.7 47 54 7.15 72 55 29.7 297 56 2.2 22 62 2.5 25 63 0.47 5 65 3.6 36 66 2.5 25 67 2.5 25 68 0.36 4 81 2.7 27 82 99.99 999 83 5 50 97 8 80 98 5.2 52 99 1.9 19 //