MassBank Record: JP002950



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

ACCESSION: JP002950
RECORD_TITLE: 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$NAME: ISOXAZOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C3H3NO CH$EXACT_MASS: 69.02146 CH$SMILES: c(c1)con1 CH$IUPAC: InChI=1S/C3H3NO/c1-2-4-5-3-1/h1-3H
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-014l-9000000000-e35161aa93f86c57f4df PK$NUM_PEAK: 19 PK$PEAK: m/z int. rel.int. 13 4.88 49 14 49.14 491 15 3.26 33 17 4.34 43 18 30.04 300 25 4.4 44 26 8.47 85 27 4.09 41 29 34.65 347 30 3.62 36 37 5.27 53 38 15.98 160 39 19.44 194 40 84.06 841 41 40.53 405 42 11.78 118 68 72.47 725 69 99.99 999 70 6.53 65 //