Debug Info

object
{15}
_id
:
4CI528irrs
spectrumID
:
4CI528irrs
cost
:
1
specType
:
131072
xnmrNucleus
:
0
dbLocation
:
WMS3X:178829:1
hasStructureAssignments
:
false
properties
{12}
analyticalTechnique
:
MS (GC)
analyticalTechniqueLongName
:
Mass Spectrum (GC)
isFullSpectrum
:
false
spectralOutlier
:
false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

Logged In :

Authorized Features

  • None
  • DataFullSpectraPoints
  • DataReadAll
  • DataReportGeneration
  • ExportCompound
  • ExportStructure
  • ExportSpectrum
  • ImageFullMS
  • ImageHighRes
  • ImageFullAxis
  • SearchSpectral
  • SearchStructure
ADVERTISEMENT
(2S,4aS,9bS)-1,2,3,4,4a,9b-Hexahydro-2,6-dimethyldibenzo[b,d]thiophene
SpectraBase Compound ID 7XGdm4UvZyx
InChI InChI=1S/C14H18S/c1-9-6-7-13-12(8-9)11-5-3-4-10(2)14(11)15-13/h3-5,9,12-13H,6-8H2,1-2H3/t9-,12-,13-/m0/s1
InChIKey WNQFQMUTTSXMCI-XDTLVQLUSA-N
Mol Weight 218.36 g/mol
Molecular Formula C14H18S
Exact Mass 218.112922 g/mol
ADVERTISEMENT

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4CI528irrs
Name (2S,4aS,9bS)-1,2,3,4,4a,9b-Hexahydro-2,6-dimethyldibenzo[b,d]thiophene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18S
InChI InChI=1S/C14H18S/c1-9-6-7-13-12(8-9)11-5-3-4-10(2)14(11)15-13/h3-5,9,12-13H,6-8H2,1-2H3/t9-,12-,13-/m0/s1
InChIKey WNQFQMUTTSXMCI-XDTLVQLUSA-N
Literature Reference DOI 10.1002/hlca.201100191
Molecular Weight 218.358 g/mol
SMILES [C@]12([C@](c3c(S2)c(ccc3)C)(C[C@](CC1)(C)[H])[H])[H]
SPLASH splash10-03xr-0940000000-457845016a869cd8ee0c
Source of Spectrum H-94-1761-3b
Synonyms (2S,4aS,9bS)-2,6-dimethyl-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]thiophene
Wiley ID 1785911
ADVERTISEMENT