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2-Undecanol palmitate

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Undecanol palmitate
SpectraBase Compound ID 6J4bPCyO0tR
InChI InChI=1S/C27H54O2/c1-4-6-8-10-12-13-14-15-16-17-19-21-23-25-27(28)29-26(3)24-22-20-18-11-9-7-5-2/h26H,4-25H2,1-3H3
InChIKey VGTOVSOELJWYCV-UHFFFAOYSA-N
Mol Weight 410.7 g/mol
Molecular Formula C27H54O2
Exact Mass 410.412381 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 72OWDR4SpSG
Name 2-Undecanol palmitate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.412380977 u
Formula C27H54O2
InChI InChI=1S/C27H54O2/c1-4-6-8-10-12-13-14-15-16-17-19-21-23-25-27(28)29-26(3)24-22-20-18-11-9-7-5-2/h26H,4-25H2,1-3H3
InChIKey VGTOVSOELJWYCV-UHFFFAOYSA-N
Molecular Weight 410.727 g/mol
SMILES C(CCCCCCCCCCCCCCC)(=O)OC(CCCCCCCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.879689