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3-Methoxy-4-methylene-2-phenyl-2-cyclobuten-1-one

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

3-Methoxy-4-methylene-2-phenyl-2-cyclobuten-1-one
SpectraBase Compound ID G3BSa9LIMXB
InChI InChI=1S/C12H10O2/c1-8-11(13)10(12(8)14-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChIKey IGYQJBKVEIMARG-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C12H10O2
Exact Mass 186.06808 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BJ0LnIS8ryk
Name 3-Methoxy-4-methylene-2-phenyl-2-cyclobuten-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 186.068079560 u
Formula C12H10O2
InChI InChI=1S/C12H10O2/c1-8-11(13)10(12(8)14-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChIKey IGYQJBKVEIMARG-UHFFFAOYSA-N
Molecular Weight 186.210 g/mol
SMILES C1(=C(OC)C(C1=O)=C)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.924922