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1-(p-Toluenesulfonyloxymethyl)-9-oxabicyclo[4.3.0]decan-8-one

View entire compound with spectra: 1 MS (GC)

1-(p-Toluenesulfonyloxymethyl)-9-oxabicyclo[4.3.0]decan-8-one
SpectraBase Compound ID 6kFMGS0prt2
InChI InChI=1S/C16H20O5S/c1-12-5-7-14(8-6-12)22(18,19)20-11-16-9-3-2-4-13(16)10-15(17)21-16/h5-8,13H,2-4,9-11H2,1H3/t13-,16+/m0/s1
InChIKey UBNHTZOXRBNYQM-XJKSGUPXSA-N
Mol Weight 324.39 g/mol
Molecular Formula C16H20O5S
Exact Mass 324.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JD9erhxgw7Q
Name 1-(p-Toluenesulfonyloxymethyl)-9-oxabicyclo[4.3.0]decan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5S
InChI InChI=1S/C16H20O5S/c1-12-5-7-14(8-6-12)22(18,19)20-11-16-9-3-2-4-13(16)10-15(17)21-16/h5-8,13H,2-4,9-11H2,1H3/t13-,16+/m0/s1
InChIKey UBNHTZOXRBNYQM-XJKSGUPXSA-N
Molecular Weight 324.391 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)[C@]12OC(=O)C[C@@]2(CCCC1)[H]
SPLASH splash10-000l-0900000000-abf8856d9df77009a2d8
Source of Spectrum E1-39-2802-24
Wiley ID 1519094