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1,3-Dioxolane-4-butanol, .beta.-ethenyl-.alpha.-(5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl)-.gamma.,2,2-trimethyl-.delta.-(phenylmethoxy)-

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

1,3-Dioxolane-4-butanol, .beta.-ethenyl-.alpha.-(5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl)-.gamma.,2,2-trimethyl-.delta.-(phenylmethoxy)-
SpectraBase Compound ID 4oSDSHUNOm8
InChI InChI=1S/C26H40O6/c1-8-19(22(27)24-20(9-2)30-26(6,7)32-24)17(3)23(21-16-29-25(4,5)31-21)28-15-18-13-11-10-12-14-18/h8,10-14,17,19-24,27H,1,9,15-16H2,2-7H3
InChIKey QIZIJJRHXQQBBK-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C26H40O6
Exact Mass 448.282489 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BUqXxiTbwwJ
Name 1,3-Dioxolane-4-butanol, .beta.-ethenyl-.alpha.-(5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl)-.gamma.,2,2-trimethyl-.delta.-(phenylmethoxy)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.282489002 u
Formula C26H40O6
InChI InChI=1S/C26H40O6/c1-8-19(22(27)24-20(9-2)30-26(6,7)32-24)17(3)23(21-16-29-25(4,5)31-21)28-15-18-13-11-10-12-14-18/h8,10-14,17,19-24,27H,1,9,15-16H2,2-7H3
InChIKey QIZIJJRHXQQBBK-UHFFFAOYSA-N
Molecular Weight 448.600 g/mol
SMILES C1(OC(C)(C)OC1CC)C(C(C(C(C1OC(C)(C)OC1)OCC1=CC=CC=C1)C)C=C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.895207