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(4aR,7R,8R,8aS)-2,2-dimethyl-7,8-bis(oxidanyl)-4a,7,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-one

View entire compound with spectra: 1 MS (GC)

(4aR,7R,8R,8aS)-2,2-dimethyl-7,8-bis(oxidanyl)-4a,7,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-one
SpectraBase Compound ID 6JIXh9JsjN
InChI InChI=1S/C9H14O6/c1-9(2)13-3-4-7(15-9)5(10)6(11)8(12)14-4/h4-7,10-11H,3H2,1-2H3/t4-,5-,6-,7-/m1/s1
InChIKey VQVADKFWISUVKU-DBRKOABJSA-N
Mol Weight 218.2 g/mol
Molecular Formula C9H14O6
Exact Mass 218.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdwwZAUvlFH
Name (4aR,7R,8R,8aS)-2,2-dimethyl-7,8-bis(oxidanyl)-4a,7,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-one
Alternate Name(s) (4aR,7R,8R,8aS)-7,8-dihydroxy-2,2-dimethyl-4a,7,8,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-6-one
CAS Registry Number 62222-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O6
InChI InChI=1S/C9H14O6/c1-9(2)13-3-4-7(15-9)5(10)6(11)8(12)14-4/h4-7,10-11H,3H2,1-2H3/t4-,5-,6-,7-/m1/s1
InChIKey VQVADKFWISUVKU-DBRKOABJSA-N
Molecular Weight 218.205 g/mol
SMILES O[C@@]1([C@]([C@]2([C@](OC1=O)(COC(O2)(C)C)[H])[H])(O)[H])[H]
SPLASH splash10-052f-9110000000-e68afdb28f9eec36d7ef
Source of Spectrum SB-31-69-0
Wiley ID 1217076