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(3a.alpha.,6a.alpha.)-Tetrahydro-2,2-dimethylspiro[cyclopenta[1,3]dioxole-5,2'-[1,3]dithiane]
SpectraBase Compound ID KpN3VbAcLfJ
InChI InChI=1S/C11H18O2S2/c1-10(2)12-8-6-11(7-9(8)13-10)14-4-3-5-15-11/h8-9H,3-7H2,1-2H3/t8-,9+
InChIKey SKAPILZYBALAQX-DTORHVGOSA-N
Mol Weight 246.38 g/mol
Molecular Formula C11H18O2S2
Exact Mass 246.074822 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 36yWcAcsqsh
Name (3A.alpha.,6A.alpha.)-Tetrahydro-2,2-dimethylspiro[cyclopenta[1,3]dioxole-5,2'-[1,3]dithiane]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 246.074822166 u
Formula C11H18O2S2
InChI InChI=1S/C11H18O2S2/c1-10(2)12-8-6-11(7-9(8)13-10)14-4-3-5-15-11/h8-9H,3-7H2,1-2H3/t8-,9+
InChIKey SKAPILZYBALAQX-DTORHVGOSA-N
Molecular Weight 246.383 g/mol
SMILES C12(C[C@]3(OC(O[C@]3(C2)[H])(C)C)[H])SCCCS1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926853