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3-but-3-en-2-yl-5,5-dimethyl-4-phenyl-2H-furan
SpectraBase Compound ID FMROFgyUHVG
InChI InChI=1S/C16H20O/c1-5-12(2)14-11-17-16(3,4)15(14)13-9-7-6-8-10-13/h5-10,12H,1,11H2,2-4H3
InChIKey CHNPUPOVEDFURL-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C16H20O
Exact Mass 228.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KpFIG3AHlFQ
Name 3-but-3-en-2-yl-5,5-Dimethyl-4-phenyl-2H-furan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.151415263 u
Formula C16H20O
InChI InChI=1S/C16H20O/c1-5-12(2)14-11-17-16(3,4)15(14)13-9-7-6-8-10-13/h5-10,12H,1,11H2,2-4H3
InChIKey CHNPUPOVEDFURL-UHFFFAOYSA-N
Molecular Weight 228.335 g/mol
SMILES C1(=C(COC1(C)C)C(C=C)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947725