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[(6R,10S)]-6,10,13-Trimethyltetradecan-2-one

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

[(6R,10S)]-6,10,13-Trimethyltetradecan-2-one
SpectraBase Compound ID FDL0DaoEadW
InChI InChI=1S/C17H34O/c1-14(2)12-13-16(4)9-6-8-15(3)10-7-11-17(5)18/h14-16H,6-13H2,1-5H3/t15-,16+/m1/s1
InChIKey MCSFHHJAWMFYRG-CVEARBPZSA-N
Mol Weight 254.5 g/mol
Molecular Formula C17H34O
Exact Mass 254.260966 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D2fQEDcZ95Y
Name [(6R,10S)]-6,10,13-Trimethyltetradecan-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.260965714 u
Formula C17H34O
InChI InChI=1S/C17H34O/c1-14(2)12-13-16(4)9-6-8-15(3)10-7-11-17(5)18/h14-16H,6-13H2,1-5H3/t15-,16+/m1/s1
InChIKey MCSFHHJAWMFYRG-CVEARBPZSA-N
Molecular Weight 254.458 g/mol
SMILES C(=O)(CCC[C@@](CCC[C@@](CCC(C)C)(C)[H])(C)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.831511