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2-Iodoethyl linoleate

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

2-Iodoethyl linoleate
SpectraBase Compound ID IMruSi3800T
InChI InChI=1S/C20H35IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h6-7,9-10H,2-5,8,11-19H2,1H3/b7-6-,10-9-
InChIKey MUKKTNFOXFDXNO-HZJYTTRNSA-N
Mol Weight 434.4 g/mol
Molecular Formula C20H35IO2
Exact Mass 434.168175 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EBuIHwWaS2Y
Name 2-Iodoethyl linoleate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.168175365 u
Formula C20H35IO2
InChI InChI=1S/C20H35IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(22)23-19-18-21/h6-7,9-10H,2-5,8,11-19H2,1H3/b7-6-,10-9-
InChIKey MUKKTNFOXFDXNO-HZJYTTRNSA-N
Molecular Weight 434.402 g/mol
SMILES C(=O)(OCCI)CCCCCCC\C=C/C\C=C/CCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.982846