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Ethyl hexadec-2E-enoate

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

Ethyl hexadec-2E-enoate
SpectraBase Compound ID FvtCSAm5XRR
InChI InChI=1S/C18H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h16-17H,3-15H2,1-2H3/b17-16+
InChIKey WKKVQOAYYIWUKZ-WUKNDPDISA-N
Mol Weight 282.5 g/mol
Molecular Formula C18H34O2
Exact Mass 282.25588 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Kkus9sD76rr
Name Ethyl hexadec-2E-enoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 282.255880333 u
Formula C18H34O2
InChI InChI=1S/C18H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h16-17H,3-15H2,1-2H3/b17-16+
InChIKey WKKVQOAYYIWUKZ-WUKNDPDISA-N
Molecular Weight 282.468 g/mol
SMILES C(\C=C\CCCCCCCCCCCCC)(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81056