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[(1S,2S,4S,5R)-2,5-dimethyl-2-oxidanyl-3-oxabicyclo[3.2.0]heptan-4-yl]methyl 2,2-dimethylpropanoate

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

[(1S,2S,4S,5R)-2,5-dimethyl-2-oxidanyl-3-oxabicyclo[3.2.0]heptan-4-yl]methyl 2,2-dimethylpropanoate
SpectraBase Compound ID GP7HQStqFmy
InChI InChI=1S/C14H24O4/c1-12(2,3)11(15)17-8-10-13(4)7-6-9(13)14(5,16)18-10/h9-10,16H,6-8H2,1-5H3/t9-,10+,13+,14-/m0/s1
InChIKey WSVBTNDNDUWVBK-PJQZNRQZSA-N
Mol Weight 256.34 g/mol
Molecular Formula C14H24O4
Exact Mass 256.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J9bANflGr90
Name [(1S,2S,4S,5R)-2,5-Dimethyl-2-oxidanyl-3-oxabicyclo[3.2.0]heptan-4-yl]methyl 2,2-dimethylpropanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.167459249 u
Formula C14H24O4
InChI InChI=1S/C14H24O4/c1-12(2,3)11(15)17-8-10-13(4)7-6-9(13)14(5,16)18-10/h9-10,16H,6-8H2,1-5H3/t9-,10+,13+,14-/m0/s1
InChIKey WSVBTNDNDUWVBK-PJQZNRQZSA-N
Molecular Weight 256.342 g/mol
SMILES [C@]1(O[C@](COC(C(C)(C)C)=O)([C@]2([C@@]1(CC2)[H])C)[H])(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943926