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1,3-Dioxaspiro[4.5]deca-6,9-dien-8-one, 6,7,9,10-tetrachloro-2-(trichloromethyl)-
SpectraBase Compound ID EPZBVfs1cHL
InChI InChI=1S/C9H3Cl7O3/c10-2-4(17)3(11)6(13)8(5(2)12)1-18-7(19-8)9(14,15)16/h7H,1H2
InChIKey PKXLAATXVSHQHD-UHFFFAOYSA-N
Mol Weight 407.3 g/mol
Molecular Formula C9H3Cl7O3
Exact Mass 403.790188 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ad2yHrRjikP
Name 1,3-Dioxaspiro[4.5]deca-6,9-dien-8-one, 6,7,9,10-tetrachloro-2-(trichloromethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.790187854 u
Formula C9H3Cl7O3
InChI InChI=1S/C9H3Cl7O3/c10-2-4(17)3(11)6(13)8(5(2)12)1-18-7(19-8)9(14,15)16/h7H,1H2
InChIKey PKXLAATXVSHQHD-UHFFFAOYSA-N
Molecular Weight 407.291 g/mol
SMILES C12(C(=C(Cl)C(C(=C2Cl)Cl)=O)Cl)OC(C(Cl)(Cl)Cl)OC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886237