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(3R,4S,5S,6S)-4-{(1E)-1,5-Dimethylhexa-1,4-dien-1-yl}-1-oxaspiro[2.5]octane-5,6-diol

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

(3R,4S,5S,6S)-4-{(1E)-1,5-Dimethylhexa-1,4-dien-1-yl}-1-oxaspiro[2.5]octane-5,6-diol
SpectraBase Compound ID 6cgjtkG8Pje
InChI InChI=1S/C15H24O3/c1-10(2)5-4-6-11(3)13-14(17)12(16)7-8-15(13)9-18-15/h5-6,12-14,16-17H,4,7-9H2,1-3H3/b11-6+/t12-,13-,14+,15-/m0/s1
InChIKey ODPDEVSBOGSMMB-QFGBMDHOSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BjcwiWBr7ne
Name (3R,4S,5S,6S)-4-{(1E)-1,5-Dimethylhexa-1,4-dien-1-yl}-1-oxaspiro[2.5]octane-5,6-diol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.172544630 u
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10(2)5-4-6-11(3)13-14(17)12(16)7-8-15(13)9-18-15/h5-6,12-14,16-17H,4,7-9H2,1-3H3/b11-6+/t12-,13-,14+,15-/m0/s1
InChIKey ODPDEVSBOGSMMB-QFGBMDHOSA-N
Molecular Weight 252.354 g/mol
SMILES [C@@]12(OC2)[C@]([C@](O)([C@](CC1)(O)[H])[H])(\C(=C\CC=C(C)C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91487