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(Z)-3-Tert-butyl-2,2-dimethylnon-5-en-3-ol

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

(Z)-3-Tert-butyl-2,2-dimethylnon-5-en-3-ol
SpectraBase Compound ID ACqM02gmLDy
InChI InChI=1S/C15H30O/c1-8-9-10-11-12-15(16,13(2,3)4)14(5,6)7/h10-11,16H,8-9,12H2,1-7H3/b11-10-
InChIKey VLQVGGCGPBWKGO-KHPPLWFESA-N
Mol Weight 226.4 g/mol
Molecular Formula C15H30O
Exact Mass 226.229666 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 73wwJqqItBs
Name (Z)-3-Tert-butyl-2,2-dimethylnon-5-en-3-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.229665585 u
Formula C15H30O
InChI InChI=1S/C15H30O/c1-8-9-10-11-12-15(16,13(2,3)4)14(5,6)7/h10-11,16H,8-9,12H2,1-7H3/b11-10-
InChIKey VLQVGGCGPBWKGO-KHPPLWFESA-N
Molecular Weight 226.404 g/mol
SMILES C(C(C)(C)C)(C(C)(C)C)(O)C\C=C/CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963069