MassBank Record: JP003037



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

ACCESSION: JP003037
RECORD_TITLE: 9-ANTHRALDEHYDE; 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$NAME: 9-ANTHRALDEHYDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H10O CH$EXACT_MASS: 206.07316 CH$SMILES: O=Cc(c21)c(c3)c(ccc3)cc(cccc2)1 CH$IUPAC: InChI=1S/C15H10O/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-10H
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: splash10-0a6r-5970000000-3289851ff043835483d6 PK$NUM_PEAK: 55 PK$PEAK: m/z int. rel.int. 50 2.5 25 51 3.7 37 60 0.5 5 61 0.08 1 62 3 30 63 6.3 63 64 0.5 5 65 0.08 1 73 1 10 74 4.8 48 75 10.7 107 76 1.73 17 77 2 20 85 1.3 13 86 2.3 23 87 0.65 7 88 26.2 262 89 20.8 208 98 2.7 27 99 0.27 3 100 0.8 8 101 2 20 102 0.8 8 103 0.75 8 110 1 10 111 1.3 13 112 0.3 3 113 0.07 1 114 0.3 3 115 1.2 12 117 1 10 122 0.08 1 123 0.7 7 124 0.5 5 125 1.3 13 126 0.28 3 127 1.7 17 128 0.8 8 149 2.3 23 150 0.1 1 151 15.3 153 152 7 70 153 1.7 17 174 0.53 5 175 11 110 176 40 400 177 40 400 178 6.65 67 179 11 110 180 0.8 8 204 4.2 42 205 0.48 5 206 99.99 999 207 16 160 208 1.7 17 //