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Dodecadienyl angelate, 2E, 4E-

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Dodecadienyl angelate, 2E, 4E-
SpectraBase Compound ID 4BPL6apB0Kl
InChI InChI=1S/C17H28O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h5,11-14H,4,6-10,15H2,1-3H3/b12-11+,14-13+,16-5-
InChIKey YXMZRTYXVKEYIU-BIXCADSVSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LfLtFUAsiPY
Name Dodecadienyl angelate, 2E, 4E-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.208930140 u
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h5,11-14H,4,6-10,15H2,1-3H3/b12-11+,14-13+,16-5-
InChIKey YXMZRTYXVKEYIU-BIXCADSVSA-N
Molecular Weight 264.409 g/mol
SMILES C\C=C/(C(=O)OC\C=C\C=C\CCCCCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930873