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Bicyclo[2.2.1]heptane-2-methanol, 6,6-ethylenedioxy-, p-toluenesulfonate
SpectraBase Compound ID 4M2QfFESyqj
InChI InChI=1S/C17H22O5S/c1-12-2-4-15(5-3-12)23(18,19)22-11-14-8-13-9-16(14)17(10-13)20-6-7-21-17/h2-5,13-14,16H,6-11H2,1H3/t13-,14-,16-/m1/s1
InChIKey XYQUKCCLEMGTNK-IIAWOOMASA-N
Mol Weight 338.42 g/mol
Molecular Formula C17H22O5S
Exact Mass 338.118795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t9r1O26VS
Name Bicyclo[2.2.1]heptane-2-methanol, 6,6-ethylenedioxy-, p-toluenesulfonate
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Formula C17H22O5S
InChI InChI=1S/C17H22O5S/c1-12-2-4-15(5-3-12)23(18,19)22-11-14-8-13-9-16(14)17(10-13)20-6-7-21-17/h2-5,13-14,16H,6-11H2,1H3/t13-,14-,16-/m1/s1
InChIKey XYQUKCCLEMGTNK-IIAWOOMASA-N
Molecular Weight 338.418 g/mol
SMILES C12(C[C@@]3(C[C@@]([C@]2(C3)[H])(COS(=O)(=O)c2ccc(C)cc2)[H])[H])OCCO1
SPLASH splash10-000w-9701000000-fa5b3809cc4713188900
Synonyms 4-Methylbenzenesulfonic acid 5'-spiro[1,3-dioxolane-2,3'-bicyclo[2.2.1]heptane]ylmethyl ester 4-Methylbenzenesulfonic acid spiro[1,3-dioxolane-2,6'-norbornane]-2'-ylmethyl ester Spiro[1,3-dioxolane-2,3'-bicyclo[2.2.1]heptane]-5'-ylmethyl 4-methylbenzenesulfonate Spiro[1,3-dioxolane-2,6'-norbornane]-2'-ylmethyl 4-methylbenzenesulfonate
Wiley ID 1484361