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E-1-Tosyloxy-6,7-epoxy-9,9-dimethyldec-4-ene-8-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

E-1-Tosyloxy-6,7-epoxy-9,9-dimethyldec-4-ene-8-one
SpectraBase Compound ID Io84NaVvJiD
InChI InChI=1S/C19H26O5S/c1-14-9-11-15(12-10-14)25(21,22)23-13-7-5-6-8-16-17(24-16)18(20)19(2,3)4/h6,8-12,16-17H,5,7,13H2,1-4H3/b8-6+
InChIKey PPHWZTFYOUYIGB-SOFGYWHQSA-N
Mol Weight 366.47 g/mol
Molecular Formula C19H26O5S
Exact Mass 366.150095 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AvZJrt4msvE
Name E-1-Tosyloxy-6,7-epoxy-9,9-dimethyldec-4-ene-8-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.150095106 u
Formula C19H26O5S
InChI InChI=1S/C19H26O5S/c1-14-9-11-15(12-10-14)25(21,22)23-13-7-5-6-8-16-17(24-16)18(20)19(2,3)4/h6,8-12,16-17H,5,7,13H2,1-4H3/b8-6+
InChIKey PPHWZTFYOUYIGB-SOFGYWHQSA-N
Molecular Weight 366.472 g/mol
SMILES C1(OC1\C=C\CCCOS(C=1C=CC(=CC1)C)(=O)=O)C(C(C)(C)C)=O