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Glutaric acid, cyclohexylmethyl 2,4-dimethylpent-3-yl ester

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Glutaric acid, cyclohexylmethyl 2,4-dimethylpent-3-yl ester
SpectraBase Compound ID 34zMdVpCMYb
InChI InChI=1S/C19H34O4/c1-14(2)19(15(3)4)23-18(21)12-8-11-17(20)22-13-16-9-6-5-7-10-16/h14-16,19H,5-13H2,1-4H3
InChIKey YZKQHJSZAPRAPY-UHFFFAOYSA-N
Mol Weight 326.5 g/mol
Molecular Formula C19H34O4
Exact Mass 326.24571 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I6iGBt9alht
Name Glutaric acid, cyclohexylmethyl 2,4-dimethylpent-3-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.245709571 u
Formula C19H34O4
InChI InChI=1S/C19H34O4/c1-14(2)19(15(3)4)23-18(21)12-8-11-17(20)22-13-16-9-6-5-7-10-16/h14-16,19H,5-13H2,1-4H3
InChIKey YZKQHJSZAPRAPY-UHFFFAOYSA-N
Molecular Weight 326.477 g/mol
SMILES C(CCC(OCC1CCCCC1)=O)C(OC(C(C)C)C(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894955