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4,5-Dimethyl-3-heptanol
SpectraBase Compound ID 31gRb1KcFjU
InChI InChI=1S/C9H20O/c1-5-7(3)8(4)9(10)6-2/h7-10H,5-6H2,1-4H3
InChIKey UETCWEUMZPDOSH-UHFFFAOYSA-N
Mol Weight 144.26 g/mol
Molecular Formula C9H20O
Exact Mass 144.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FewCWj1mW40
Name 4,5-Dimethyl-3-heptanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 144.151415263 u
Formula C9H20O
InChI InChI=1S/C9H20O/c1-5-7(3)8(4)9(10)6-2/h7-10H,5-6H2,1-4H3
InChIKey UETCWEUMZPDOSH-UHFFFAOYSA-N
Molecular Weight 144.258 g/mol
SMILES C(O)(CC)C(C(CC)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959612