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3-Tert-butyl-2,2-dimethyldec-5-yn-3-ol

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

3-Tert-butyl-2,2-dimethyldec-5-yn-3-ol
SpectraBase Compound ID IhJq0okmwar
InChI InChI=1S/C16H30O/c1-8-9-10-11-12-13-16(17,14(2,3)4)15(5,6)7/h17H,8-10,13H2,1-7H3
InChIKey ILXJDWXOVJCPAQ-UHFFFAOYSA-N
Mol Weight 238.41 g/mol
Molecular Formula C16H30O
Exact Mass 238.229666 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2yETAsPxC6B
Name 3-Tert-butyl-2,2-dimethyldec-5-yn-3-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.229665585 u
Formula C16H30O
InChI InChI=1S/C16H30O/c1-8-9-10-11-12-13-16(17,14(2,3)4)15(5,6)7/h17H,8-10,13H2,1-7H3
InChIKey ILXJDWXOVJCPAQ-UHFFFAOYSA-N
Molecular Weight 238.415 g/mol
SMILES C(C(C)(C)C)(C(C)(C)C)(CC#CCCCC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969106