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

*Links on SpectraBase are not permalinks.

4-Methyl-1,3-dithiane

View entire compound with spectra: 7 NMR, and 2 MS (GC)

4-Methyl-1,3-dithiane
SpectraBase Compound ID I1glBJR0GpT
InChI InChI=1S/C5H10S2/c1-5-2-3-6-4-7-5/h5H,2-4H2,1H3
InChIKey HAXRZEWLQORZFV-UHFFFAOYSA-N
Mol Weight 134.25 g/mol
Molecular Formula C5H10S2
Exact Mass 134.022393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3iE51p87hiI
Name 4-Methyl-1,3-dithiane
CAS Registry Number 52884-63-6
Comments 93 % EQUATORIAL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H10S2
InChI InChI=1S/C5H10S2/c1-5-2-3-6-4-7-5/h5H,2-4H2,1H3
InChIKey HAXRZEWLQORZFV-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference K. Pihlaja, B. Bjoerkqvist, Org. Magn. Resonance 9, 533 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3