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2,2,3,7,8,8-Hexamethyl-5-methylene-nonane-3,7-diol

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

2,2,3,7,8,8-Hexamethyl-5-methylene-nonane-3,7-diol
SpectraBase Compound ID 2kUSp2VJN8p
InChI InChI=1S/C16H32O2/c1-12(10-15(8,17)13(2,3)4)11-16(9,18)14(5,6)7/h17-18H,1,10-11H2,2-9H3
InChIKey MCZSATSMLBMWAI-UHFFFAOYSA-N
Mol Weight 256.4 g/mol
Molecular Formula C16H32O2
Exact Mass 256.24023 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AkFicrsk9yx
Name 2,2,3,7,8,8-Hexamethyl-5-methylene-nonane-3,7-diol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.240230268 u
Formula C16H32O2
InChI InChI=1S/C16H32O2/c1-12(10-15(8,17)13(2,3)4)11-16(9,18)14(5,6)7/h17-18H,1,10-11H2,2-9H3
InChIKey MCZSATSMLBMWAI-UHFFFAOYSA-N
Molecular Weight 256.430 g/mol
SMILES C(C(C)(C)C)(CC(CC(C(C)(C)C)(O)C)=C)(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973995