MassBank Record: JP003294



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

ACCESSION: JP003294
RECORD_TITLE: N-ETHYL-O-TOLUENESULFONAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: N-ETHYL-O-TOLUENESULFONAMIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H13NO2S CH$EXACT_MASS: 199.06670 CH$SMILES: CCNS(=O)(=O)c(c1)c(C)ccc1 CH$IUPAC: InChI=1S/C9H13NO2S/c1-3-10-13(11,12)9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3
AC$INSTRUMENT: JEOL JMS-01-SG-2 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-9700000000-939c8ed5ece25033bd37 PK$NUM_PEAK: 40 PK$PEAK: m/z int. rel.int. 44 48.8 488 45 1.6 16 50 3.3 33 51 6.7 67 52 2.2 22 53 1.7 17 57 1.9 19 61 3 30 62 11.4 114 63 3.7 37 65 54.7 547 66 3 30 77 6.8 68 78 2.7 27 79 2.1 21 89 12 120 90 22.7 227 91 99.99 999 92 16.8 168 106 6.8 68 107 5.7 57 108 3.5 35 109 1.6 16 111 1.5 15 120 7.4 74 134 2.3 23 137 4.9 49 139 8 80 154 1.7 17 155 87.8 878 156 6.8 68 157 4 40 171 6 60 180 1.7 17 184 41.3 413 185 4.7 47 186 1.7 17 199 40.4 404 200 8.7 87 201 2.7 27 //