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Methanesulfonic acid, trifluoro-, 3-cyano-2-oxatricyclo[3.3.1.1(3,7)]dec-1-yl ester
SpectraBase Compound ID I8dsaTEIFnG
InChI InChI=1S/C11H12F3NO4S/c12-11(13,14)20(16,17)19-10-4-7-1-8(5-10)3-9(2-7,6-15)18-10/h7-8H,1-5H2/t7-,8+,9?,10-
InChIKey HIOJRLVHLKACCX-UNVPZKBBSA-N
Mol Weight 311.28 g/mol
Molecular Formula C11H12F3NO4S
Exact Mass 311.043914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0f2RrNZqnY
Name Methanesulfonic acid, trifluoro-, 3-cyano-2-oxatricyclo[3.3.1.1(3,7)]dec-1-yl ester
CAS Registry Number 59223-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12F3NO4S
InChI InChI=1S/C11H12F3NO4S/c12-11(13,14)20(16,17)19-10-4-7-1-8(5-10)3-9(2-7,6-15)18-10/h7-8H,1-5H2/t7-,8+,9?,10-
InChIKey HIOJRLVHLKACCX-UNVPZKBBSA-N
Molecular Weight 311.275 g/mol
SMILES [C@]12(OS(C(F)(F)F)(=O)=O)OC3(C#N)C[C@@](C2)(C[C@@](C1)(C3)[H])[H]
SPLASH splash10-02t9-9501000000-c500d9ac9fc26e5fa349
Source of Spectrum C-98-1233-0
Synonyms 2-Oxatricyclo[3.3.1.1(3,7)]decane, methanesulfonic acid deriv. 3-cyano-2-oxatricyclo[3.3.1.1(3,7)]dec-1-yl trifluoromethanesulfonate 3-Cyano-2-oxo-1-adamanatyl trifluoroate
Wiley ID 1312191