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2,7-bis-[2-(2-Chloro-ethoxy)-ethoxy]-fluoren-9-one
SpectraBase Compound ID 8rsszDfzDou
InChI InChI=1S/C21H22Cl2O5/c22-5-7-25-9-11-27-15-1-3-17-18-4-2-16(28-12-10-26-8-6-23)14-20(18)21(24)19(17)13-15/h1-4,13-14H,5-12H2
InChIKey XCZYRJCQAUMJLP-UHFFFAOYSA-N
Mol Weight 425.31 g/mol
Molecular Formula C21H22Cl2O5
Exact Mass 424.084429 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gz3a6AqBhS3
Name 2,7-bis-[2-(2-Chloro-ethoxy)-ethoxy]-fluoren-9-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.084429203 u
Formula C21H22Cl2O5
InChI InChI=1S/C21H22Cl2O5/c22-5-7-25-9-11-27-15-1-3-17-18-4-2-16(28-12-10-26-8-6-23)14-20(18)21(24)19(17)13-15/h1-4,13-14H,5-12H2
InChIKey XCZYRJCQAUMJLP-UHFFFAOYSA-N
Molecular Weight 425.308 g/mol
SMILES C1=2C(C3=CC(OCCOCCCl)=CC=C3C2C=CC(=C1)OCCOCCCl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.845654