For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(3aS*,7aR*)-2,2-Diisopropyl-2,3,3a,4,5,7a-hexahydrobenzofuran

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(3aS*,7aR*)-2,2-Diisopropyl-2,3,3a,4,5,7a-hexahydrobenzofuran
SpectraBase Compound ID 2MTIg77YQ8W
InChI InChI=1S/C14H24O/c1-10(2)14(11(3)4)9-12-7-5-6-8-13(12)15-14/h6,8,10-13H,5,7,9H2,1-4H3/t12-,13-/m0/s1
InChIKey QZVMQQVFJVIYDD-STQMWFEESA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID G5j92VuC4Me
Name (3as*,7ar*)-2,2-Diisopropyl-2,3,3A,4,5,7A-hexahydrobenzofuran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-10(2)14(11(3)4)9-12-7-5-6-8-13(12)15-14/h6,8,10-13H,5,7,9H2,1-4H3/t12-,13-/m0/s1
InChIKey QZVMQQVFJVIYDD-STQMWFEESA-N
Molecular Weight 208.345 g/mol
SMILES C1(O[C@]2(C=CCC[C@]2(C1)[H])[H])(C(C)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947133