MassBank Record: JP003235



 3,5-DIMETHYL-4-(2'-TETRALOYL)METHYL-ISOXAZOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003235
RECORD_TITLE: 3,5-DIMETHYL-4-(2'-TETRALOYL)METHYL-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$NAME: 3,5-DIMETHYL-4-(2'-TETRALOYL)METHYL-ISOXAZOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H17NO2 CH$EXACT_MASS: 255.12593 CH$SMILES: Cc(n3)c(c(C)o3)CC(C1)C(=O)c(c2)c(ccc2)C1 CH$IUPAC: InChI=1S/C16H17NO2/c1-10-15(11(2)19-17-10)9-13-8-7-12-5-3-4-6-14(12)16(13)18/h3-6,13H,7-9H2,1-2H3
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$SPLASH: splash10-03dl-8940000000-2d21847a39cab190e672 PK$NUM_PEAK: 8 PK$PEAK: m/z int. rel.int. 255 45 450 212 29 290 146 46 460 110 99.99 999 68 64 640 43 58 580 42 12 120 41 3 30 //