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(1R,3R,5S)-3,5-Dimethylthiane 1-Oxide
SpectraBase Compound ID 4Jy4GawDTTr
InChI InChI=1S/C7H14OS/c1-6-3-7(2)5-9(8)4-6/h6-7H,3-5H2,1-2H3/t6-,7+,9?
InChIKey BRWNUPIMLVDPBZ-AVSFMBPQSA-N
Mol Weight 146.25 g/mol
Molecular Formula C7H14OS
Exact Mass 146.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hkBTEPGsu1
Name (1R,3R,5S)-3,5-Dimethylthiane 1-Oxide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14OS
InChI InChI=1S/C7H14OS/c1-6-3-7(2)5-9(8)4-6/h6-7H,3-5H2,1-2H3/t6-,7+,9?
InChIKey BRWNUPIMLVDPBZ-AVSFMBPQSA-N
Instrument Name Finnigan MAT-95
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000198
Molecular Weight 146.248 g/mol
Reported Formula C7H14O(32)S
SMILES C1[C@@](CS(C[C@@]1(C)[H])=O)(C)[H]
SPLASH splash10-0a5a-9300000000-eb9119584b419bc82812
Source of Spectrum U1-2020-2883-3
Wiley ID 1860556