MassBank Record: JP003022



 3-TERT-BUTYLMERCAPTO-4,5-LUTIDINE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003022
RECORD_TITLE: 3-TERT-BUTYLMERCAPTO-4,5-LUTIDINE; 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$NAME: 3-TERT-BUTYLMERCAPTO-4,5-LUTIDINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H17NS CH$EXACT_MASS: 195.10817 CH$SMILES: Cc(c1)c(C)c(cn1)SC(C)(C)C CH$IUPAC: InChI=1S/C11H17NS/c1-8-6-12-7-10(9(8)2)13-11(3,4)5/h6-7H,1-5H3
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: splash10-000i-2900000000-0138e6614289a217f946 PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 29 8 80 39 8 80 41 16 160 57 3 30 67 7 70 106 9 90 138 7 70 139 99.99 999 140 11 110 141 5 50 180 1 10 195 0.12 1 196 1.5 15 //