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Undecane, 5-(bromomethyl)-2,2,4,8,10,10-hexamethyl-

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

Undecane, 5-(bromomethyl)-2,2,4,8,10,10-hexamethyl-
SpectraBase Compound ID JyZz0mzgJf8
InChI InChI=1S/C18H37Br/c1-14(11-17(3,4)5)9-10-16(13-19)15(2)12-18(6,7)8/h14-16H,9-13H2,1-8H3
InChIKey LZKYWQWTXFXFQI-UHFFFAOYSA-N
Mol Weight 333.4 g/mol
Molecular Formula C18H37Br
Exact Mass 332.207864 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ID4cqiIpgNX
Name Undecane, 5-(bromomethyl)-2,2,4,8,10,10-hexamethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.207864191 u
Formula C18H37Br
InChI InChI=1S/C18H37Br/c1-14(11-17(3,4)5)9-10-16(13-19)15(2)12-18(6,7)8/h14-16H,9-13H2,1-8H3
InChIKey LZKYWQWTXFXFQI-UHFFFAOYSA-N
Molecular Weight 333.398 g/mol
SMILES C(C(C(CCC(CC(C)(C)C)C)CBr)C)C(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941487