MassBank MassBank Search Contents Download

MassBank Record: JP009165

S-PROPYL THIOACETATE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP009165
RECORD_TITLE: S-PROPYL THIOACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: S-PROPYL THIOACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10OS
CH$EXACT_MASS: 118.04524
CH$SMILES: CCCSC(C)=O
CH$IUPAC: InChI=1S/C5H10OS/c1-3-4-7-5(2)6/h3-4H2,1-2H3
CH$LINK: INCHIKEY SBWFWBJCYMBZEY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30177638

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9000000000-9d59c00678babcad2e23
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  15 3.56 36
  27 6.71 67
  29 1.2 12
  39 5.68 57
  41 8.46 85
  42 6.84 68
  43 99.99 999
  44 2.1 21
  45 5.43 54
  46 2.4 24
  47 5.75 58
  58 1.46 15
  59 1.55 16
  61 1.13 11
  74 3.58 36
  75 2.48 25
  76 3.39 34
  77 3.17 32
  118 11.82 118
//

Imprint Feedback
system version 2.1.8
Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium
Responsible: Dr. Tobias Schulze