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(4-chlorophenyl)-(4,5-dimethyl-3,6-dihydro-2H-pyran-2-yl)methanone
SpectraBase Compound ID 3Rxi2ZEJQLm
InChI InChI=1S/C14H15ClO2/c1-9-7-13(17-8-10(9)2)14(16)11-3-5-12(15)6-4-11/h3-6,13H,7-8H2,1-2H3
InChIKey RAAOUSVFZXHIAB-UHFFFAOYSA-N
Mol Weight 250.72 g/mol
Molecular Formula C14H15ClO2
Exact Mass 250.076057 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EkvSelhHiTN
Name (4-Chlorophenyl)-(4,5-dimethyl-3,6-dihydro-2H-pyran-2-yl)methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.076057421 u
Formula C14H15ClO2
InChI InChI=1S/C14H15ClO2/c1-9-7-13(17-8-10(9)2)14(16)11-3-5-12(15)6-4-11/h3-6,13H,7-8H2,1-2H3
InChIKey RAAOUSVFZXHIAB-UHFFFAOYSA-N
Molecular Weight 250.725 g/mol
SMILES C1(=C(COC(C1)C(C1=CC=C(C=C1)Cl)=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965278