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Thiane 1-oxide

View entire compound with spectra: 74 NMR, and 2 MS (GC)

Thiane 1-oxide
SpectraBase Compound ID AlnP3yYy87P
InChI InChI=1S/C5H10OS/c6-7-4-2-1-3-5-7/h1-5H2
InChIKey NNLBRYQGMOYARS-UHFFFAOYSA-N
Mol Weight 118.19 g/mol
Molecular Formula C5H10OS
Exact Mass 118.045236 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID bTC6H6QFzc
Name Tetrahydro-thiopyran 1-oxide
CAS Registry Number 4988-34-5
Comments EQ SO, SAME CHEMICAL SHIFTS IN CD3COCD3, CD2CL2, THF-D8, CDCL3, CHF2CL
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C5H10OS
InChI InChI=1S/C5H10OS/c6-7-4-2-1-3-5-7/h1-5H2
InChIKey NNLBRYQGMOYARS-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G. Barbarella, P. Dembech, V. Tugnoli, Org. Magn. Resonance 22, 402 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD