MassBank Record: JP000920



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

ACCESSION: JP000920
RECORD_TITLE: 4-PENTENYL ISOTHIOCYANATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KAMEOKA H, DEPT. OF APPLIED CHEMISTRY, FAC. OF SCI. AND ENGINEERING, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 4-PENTENYL ISOTHIOCYANATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H9NS CH$EXACT_MASS: 127.04557 CH$SMILES: C=CCCCN=C=S CH$IUPAC: InChI=1S/C6H9NS/c1-2-3-4-5-7-6-8/h2H,1,3-5H2
AC$INSTRUMENT: SHIMADZU LKB-9000B AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0076-9100000000-b80ff5278e20ade2da97 PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 39 53.2 532 41 99.99 999 42 12.8 128 45 1.49 15 53 23.4 234 55 19.2 192 58 10.6 106 59 0.85 9 60 12.8 128 67 34 340 68 14.9 149 69 1.06 11 70 34 340 72 25.5 255 85 21.3 213 99 1.7 17 126 14.9 149 127 17 170 128 6 60 129 7.5 75 //