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Glutaric acid, monochloride, 2-ethylbutyl ester

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Glutaric acid, monochloride, 2-ethylbutyl ester
SpectraBase Compound ID 8LDLUmox4QN
InChI InChI=1S/C11H19ClO3/c1-3-9(4-2)8-15-11(14)7-5-6-10(12)13/h9H,3-8H2,1-2H3
InChIKey QQIRYCRKMQJXDV-UHFFFAOYSA-N
Mol Weight 234.72 g/mol
Molecular Formula C11H19ClO3
Exact Mass 234.102272 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BcVt4NETkf4
Name Glutaric acid, monochloride, 2-ethylbutyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.102272169 u
Formula C11H19ClO3
InChI InChI=1S/C11H19ClO3/c1-3-9(4-2)8-15-11(14)7-5-6-10(12)13/h9H,3-8H2,1-2H3
InChIKey QQIRYCRKMQJXDV-UHFFFAOYSA-N
Molecular Weight 234.723 g/mol
SMILES CCC(CC)COC(CCCC(Cl)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.982635