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1-(6-Methyl-4,4-diphenyl-5-oxaspiro[2.4]hept-6-en-7-yl)ethanone
SpectraBase Compound ID CW798SQ7AXf
InChI InChI=1S/C21H20O2/c1-15(22)19-16(2)23-21(20(19)13-14-20,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3
InChIKey KRNGNKNYYOVDDO-UHFFFAOYSA-N
Mol Weight 304.39 g/mol
Molecular Formula C21H20O2
Exact Mass 304.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8wqqYJ94BgQ
Name 1-(6-Methyl-4,4-diphenyl-5-oxaspiro[2.4]hept-6-en-7-yl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.146329882 u
Formula C21H20O2
InChI InChI=1S/C21H20O2/c1-15(22)19-16(2)23-21(20(19)13-14-20,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3
InChIKey KRNGNKNYYOVDDO-UHFFFAOYSA-N
Molecular Weight 304.389 g/mol
SMILES C(C)(C=1C2(CC2)C(OC1C)(C=1C=CC=CC1)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93807