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Succinic acid, dec-2-yl 8-chlorooctyl ester
SpectraBase Compound ID 779qwYVstGM
InChI InChI=1S/C22H41ClO4/c1-3-4-5-6-9-12-15-20(2)27-22(25)17-16-21(24)26-19-14-11-8-7-10-13-18-23/h20H,3-19H2,1-2H3
InChIKey IKHVJILWQHTJFO-UHFFFAOYSA-N
Mol Weight 405.0 g/mol
Molecular Formula C22H41ClO4
Exact Mass 404.269337 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1pquQ65g6HA
Name Succinic acid, dec-2-yl 8-chlorooctyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.269337496 u
Formula C22H41ClO4
InChI InChI=1S/C22H41ClO4/c1-3-4-5-6-9-12-15-20(2)27-22(25)17-16-21(24)26-19-14-11-8-7-10-13-18-23/h20H,3-19H2,1-2H3
InChIKey IKHVJILWQHTJFO-UHFFFAOYSA-N
Molecular Weight 405.019 g/mol
SMILES C(CC(OC(CCCCCCCC)C)=O)C(OCCCCCCCCCl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927001