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Butyl 11-eicosenoate

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

Butyl 11-eicosenoate
SpectraBase Compound ID G28GW9doHiE
InChI InChI=1S/C24H46O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(25)26-23-6-4-2/h12-13H,3-11,14-23H2,1-2H3/b13-12-
InChIKey OEMCENPXQYTHAH-SEYXRHQNSA-N
Mol Weight 366.6 g/mol
Molecular Formula C24H46O2
Exact Mass 366.349781 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GSz9p7bG6aL
Name Butyl 11-eicosenoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.349780719 u
Formula C24H46O2
InChI InChI=1S/C24H46O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(25)26-23-6-4-2/h12-13H,3-11,14-23H2,1-2H3/b13-12-
InChIKey OEMCENPXQYTHAH-SEYXRHQNSA-N
Molecular Weight 366.630 g/mol
SMILES C(CCCCCCCC\C=C/CCCCCCCC)C(OCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.967665