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2,4,6-Trimethyl-8-(tetrahydropyran-2-yloxy)nonane iodide

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

2,4,6-Trimethyl-8-(tetrahydropyran-2-yloxy)nonane iodide
SpectraBase Compound ID LbR1cJc99ND
InChI InChI=1S/C17H33IO2/c1-13(10-15(3)12-18)9-14(2)11-16(4)20-17-7-5-6-8-19-17/h13-17H,5-12H2,1-4H3
InChIKey WWLDIRZAAIMYFT-UHFFFAOYSA-N
Mol Weight 396.4 g/mol
Molecular Formula C17H33IO2
Exact Mass 396.152525 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5gctmlEAbLw
Name 2,4,6-Trimethyl-8-(tetrahydropyran-2-yloxy)nonane iodide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.152525301 u
Formula C17H33IO2
InChI InChI=1S/C17H33IO2/c1-13(10-15(3)12-18)9-14(2)11-16(4)20-17-7-5-6-8-19-17/h13-17H,5-12H2,1-4H3
InChIKey WWLDIRZAAIMYFT-UHFFFAOYSA-N
Molecular Weight 396.353 g/mol
SMILES C(C(CC(CC(CC(C)OC1CCCCO1)C)C)C)I
Spectrum/Structure Validation Score (Vapor Phase IR) 0.869118