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Methyl 2,4-dimethyl-tricosanoate
SpectraBase Compound ID 485Qa8Gr6WU
InChI InChI=1S/C26H52O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(2)23-25(3)26(27)28-4/h24-25H,5-23H2,1-4H3
InChIKey RJWYFNAFPDFNMU-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C26H52O2
Exact Mass 396.396731 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FMV1b8e11cG
Name Methyl 2,4-dimethyl-tricosanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.396730912 u
Formula C26H52O2
InChI InChI=1S/C26H52O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(2)23-25(3)26(27)28-4/h24-25H,5-23H2,1-4H3
InChIKey RJWYFNAFPDFNMU-UHFFFAOYSA-N
Molecular Weight 396.700 g/mol
SMILES C(C(CC(CCCCCCCCCCCCCCCCCCC)C)C)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945889