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(1R,2R,3R,5R)-2,3-Epoxy-5-isopropenyl-2-methyl-1-tosylcyclohexane
SpectraBase Compound ID 7Dt9W0ZR4k1
InChI InChI=1S/C17H22O4S/c1-11(2)13-9-15-17(4,20-15)16(10-13)21-22(18,19)14-7-5-12(3)6-8-14/h5-8,13,15-16H,1,9-10H2,2-4H3/t13-,15-,16+,17-/m1/s1
InChIKey ZPIQDLHLUKTIHC-MXASKKJJSA-N
Mol Weight 322.42 g/mol
Molecular Formula C17H22O4S
Exact Mass 322.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzMEi5O47ip
Name (1R,2R,3R,5R)-2,3-Epoxy-5-isopropenyl-2-methyl-1-tosylcyclohexane
Alternate Name(s) (1R,2R,4R,6R)-4-isopropenyl-1-methyl-7-oxabicyclo[4.1.0]hept-2-yl 4-methylbenzenesulfonate (1S)-2,3-Epoxy-5-isopropenyl-2-methyl-1-tosylcyclohexane Toluene-4-sulfonic acid (1R,2S,4R,6R)-4-isopropenyl-1-methyl-7-oxa-bicyclo[4.1.0]hept-2-yl ester 4-Methylbenzenesulfonic acid [(1R,3R,5S,6R)-6-methyl-3-(1-methylethenyl)-7-oxabicyclo[4.1.0]heptan-5-yl] ester [(1R,3R,5S,6R)-3-isopropenyl-6-methyl-7-oxabicyclo[4.1.0]heptan-5-yl] 4-methylbenzenesulfonate [(1R,3R,5S,6R)-6-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptan-5-yl] 4-methylbenzenesulfonate
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Formula C17H22O4S
InChI InChI=1S/C17H22O4S/c1-11(2)13-9-15-17(4,20-15)16(10-13)21-22(18,19)14-7-5-12(3)6-8-14/h5-8,13,15-16H,1,9-10H2,2-4H3/t13-,15-,16+,17-/m1/s1
InChIKey ZPIQDLHLUKTIHC-MXASKKJJSA-N
Molecular Weight 322.419 g/mol
SMILES [C@@]12(O[C@@]2(C[C@](C[C@@]1(OS(c1ccc(cc1)C)(=O)=O)[H])(C(=C)C)[H])[H])C
SPLASH splash10-0006-9300000000-b2166975c92e75b09e89
Source of Spectrum SK-25-3918-6
Wiley ID 865907