MassBank Record: JP002996



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

ACCESSION: JP002996
RECORD_TITLE: 4-TERT-BUTYLMERCAPTOPYRIDINECAPTOPYRIDINE; 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$NAME: 4-TERT-BUTYLMERCAPTOPYRIDINECAPTOPYRIDINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H13NS CH$EXACT_MASS: 167.07687 CH$SMILES: CC(C)(C)Sc(c1)ccnc1 CH$IUPAC: InChI=1S/C9H13NS/c1-9(2,3)11-8-4-6-10-7-5-8/h4-7H,1-3H3
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: splash10-0bt9-9500000000-d559545a786a3c454fd3 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 29 31 310 32 9 90 39 24 240 41 5 50 51 1 10 55 6 60 56 5 50 57 99.99 999 58 6 60 59 7 70 67 12 120 83 0.05 1 84 3 30 110 4 40 111 84 840 112 0.2 2 113 5 50 152 4 40 167 22 220 168 0.03 0 169 1.5 15 //