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Hexadecane, 1,1-bis(dodecyloxy)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Hexadecane, 1,1-bis(dodecyloxy)-
SpectraBase Compound ID 7sc1TbD7QHg
InChI InChI=1S/C40H82O2/c1-4-7-10-13-16-19-22-23-24-25-28-31-34-37-40(41-38-35-32-29-26-20-17-14-11-8-5-2)42-39-36-33-30-27-21-18-15-12-9-6-3/h40H,4-39H2,1-3H3
InChIKey IQWYYPSAYLKEME-UHFFFAOYSA-N
Mol Weight 595.1 g/mol
Molecular Formula C40H82O2
Exact Mass 594.631482 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DFYAUmixn2Z
Name Hexadecane, 1,1-bis(dodecyloxy)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 594.631481878 u
Formula C40H82O2
InChI InChI=1S/C40H82O2/c1-4-7-10-13-16-19-22-23-24-25-28-31-34-37-40(41-38-35-32-29-26-20-17-14-11-8-5-2)42-39-36-33-30-27-21-18-15-12-9-6-3/h40H,4-39H2,1-3H3
InChIKey IQWYYPSAYLKEME-UHFFFAOYSA-N
Molecular Weight 595.094 g/mol
SMILES C(C(OCCCCCCCCCCCC)OCCCCCCCCCCCC)CCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.83884