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(1S)-1-[(4S,5S)-2,2-dimethyl-5-[(1S)-1-oxidanylprop-2-enyl]-1,3-dioxolan-4-yl]prop-2-en-1-ol

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

(1S)-1-[(4S,5S)-2,2-dimethyl-5-[(1S)-1-oxidanylprop-2-enyl]-1,3-dioxolan-4-yl]prop-2-en-1-ol
SpectraBase Compound ID 5luiwMkPtV3
InChI InChI=1S/C11H18O4/c1-5-7(12)9-10(8(13)6-2)15-11(3,4)14-9/h5-10,12-13H,1-2H2,3-4H3/t7-,8-,9-,10-/m0/s1
InChIKey OBQNNVHYIFDXBV-XKNYDFJKSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H2kpZuxTAt0
Name (1S)-1-[(4S,5S)-2,2-Dimethyl-5-[(1S)-1-oxidanylprop-2-enyl]-1,3-dioxolan-4-yl]prop-2-en-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.120509056 u
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-5-7(12)9-10(8(13)6-2)15-11(3,4)14-9/h5-10,12-13H,1-2H2,3-4H3/t7-,8-,9-,10-/m0/s1
InChIKey OBQNNVHYIFDXBV-XKNYDFJKSA-N
Molecular Weight 214.261 g/mol
SMILES [C@]1([C@@](OC(O1)(C)C)([C@](C=C)(O)[H])[H])([C@](C=C)(O)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910378