MassBank Record: JP008092



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

ACCESSION: JP008092
RECORD_TITLE: N'-PHENYLBENZOTHIOCARBOHYDRAZIDE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO MDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: N'-PHENYLBENZOTHIOCARBOHYDRAZIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H12N2S CH$EXACT_MASS: 228.07212 CH$SMILES: S=C(NNc(c2)cccc2)c(c1)cccc1 CH$IUPAC: InChI=1S/C13H12N2S/c16-13(11-7-3-1-4-8-11)15-14-12-9-5-2-6-10-12/h1-10,14H,(H,15,16) CH$LINK: INCHIKEY AWAWNMNDLBQMDV-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-HX-100 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 22 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00bc-3950000000-2ab4d6a5269aaacbd918 PK$NUM_PEAK: 98 PK$PEAK: m/z int. rel.int. 15 0.12 1 28 0.67 7 32 0.22 2 33 0.15 2 34 0.25 3 36 0.27 3 38 0.2 2 39 0.26 3 40 0.14 1 41 0.21 2 42 0.16 2 44 0.17 2 45 0.68 7 47 0.13 1 51 0.19 2 53 0.17 2 54 0.13 1 56 0.11 1 57 0.15 2 61 0.14 1 62 0.14 1 63 0.29 3 64 1.05 11 65 7.3 73 66 1.37 14 67 0.13 1 69 0.14 1 71 0.14 1 77 6.65 67 78 1.02 10 79 0.41 4 80 0.8 8 81 0.55 6 90 0.22 2 91 30.9 309 92 18.59 186 93 9.92 99 94 0.67 7 97 0.42 4 98 0.11 1 102 0.2 2 104 6.83 68 105 1.36 14 106 0.19 2 107 5.85 59 108 0.37 4 109 1.07 11 110 0.14 1 114 0.54 5 116 0.1 1 117 0.13 1 118 0.27 3 119 17.01 170 120 1.63 16 121 89.56 896 122 9.73 97 123 6.19 62 124 1.34 13 125 8.2 82 126 0.81 8 127 0.48 5 131 0.23 2 133 0.13 1 135 0.29 3 136 0.35 4 143 0.14 1 147 0.14 1 149 0.65 7 150 0.42 4 155 0.13 1 159 0.13 1 162 0.14 1 164 0.13 1 165 0.62 6 166 0.52 5 167 1.23 12 168 0.45 5 170 0.15 2 178 0.14 1 188 0.52 5 189 0.28 3 192 0.4 4 193 1.72 17 194 29.27 293 195 6.28 63 196 0.39 4 199 0.29 3 200 0.16 2 205 0.13 1 210 0.13 1 211 0.13 1 212 0.17 2 226 0.19 2 227 2.79 28 228 99.99 999 229 18.69 187 230 6.67 67 231 0.99 10 //

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