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4-Octene, 2,7-dimethyl-4,5-bis(2-methylpropyl)-

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4-Octene, 2,7-dimethyl-4,5-bis(2-methylpropyl)-
SpectraBase Compound ID FEjWsP0JFsm
InChI InChI=1S/C18H36/c1-13(2)9-17(10-14(3)4)18(11-15(5)6)12-16(7)8/h13-16H,9-12H2,1-8H3
InChIKey DMKJYBBEQDOAMV-UHFFFAOYSA-N
Mol Weight 252.5 g/mol
Molecular Formula C18H36
Exact Mass 252.281701 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LN9nk1zQ08y
Name 4-Octene, 2,7-dimethyl-4,5-bis(2-methylpropyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.281701159 u
Formula C18H36
InChI InChI=1S/C18H36/c1-13(2)9-17(10-14(3)4)18(11-15(5)6)12-16(7)8/h13-16H,9-12H2,1-8H3
InChIKey DMKJYBBEQDOAMV-UHFFFAOYSA-N
Molecular Weight 252.486 g/mol
SMILES C(=C(CC(C)C)CC(C)C)(CC(C)C)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.872043