For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-((2-(2-Methylallyl)cyclobut-1-en-1-yl)ethynyl)thiophene
SpectraBase Compound ID IXaYl98ZdK8
InChI InChI=1S/C14H14S/c1-11(2)9-14-6-5-13(14)4-3-12-7-8-15-10-12/h7-8,10H,1,5-6,9H2,2H3
InChIKey UTBZUVZRNZXSNV-UHFFFAOYSA-N
Mol Weight 214.33 g/mol
Molecular Formula C14H14S
Exact Mass 214.081622 g/mol

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 CfCnxYxxsf0
Name 3-((2-(2-Methylallyl)cyclobut-1-en-1-yl)ethynyl)thiophene
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.081621625 u
Formula C14H14S
InChI InChI=1S/C14H14S/c1-11(2)9-14-6-5-13(14)4-3-12-7-8-15-10-12/h7-8,10H,1,5-6,9H2,2H3
InChIKey UTBZUVZRNZXSNV-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604585
Molecular Weight 214.326 g/mol
Quality 250
Reported Formula C14H14S
SMILES C=1(C#CC=2C=CSC2)CCC1CC(=C)C
SPLASH splash10-015a-1910000000-2874ee19ebcd7868a16f
Source of Spectrum QE-23-SM44-22c (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.6 (hexane, UV, KMnO4, PAA)
Wiley ID 1903902