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1-(2,2,T-3,C-6-Tetramethyl-R-1-cyclohexyl)-3-hexanol
SpectraBase Compound ID HMvKq8FSyoh
InChI InChI=1S/C16H32O/c1-6-7-14(17)10-11-15-12(2)8-9-13(3)16(15,4)5/h12-15,17H,6-11H2,1-5H3/t12-,13-,14?,15-/m1/s1
InChIKey ZXEXKFFXTYZXJT-QKGHYUKFSA-N
Mol Weight 240.4 g/mol
Molecular Formula C16H32O
Exact Mass 240.245316 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6WSHi2wDyYj
Name 1-(2,2,T-3,C-6-Tetramethyl-R-1-cyclohexyl)-3-hexanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.245315649 u
Formula C16H32O
InChI InChI=1S/C16H32O/c1-6-7-14(17)10-11-15-12(2)8-9-13(3)16(15,4)5/h12-15,17H,6-11H2,1-5H3/t12-,13-,14?,15-/m1/s1
InChIKey ZXEXKFFXTYZXJT-QKGHYUKFSA-N
Molecular Weight 240.431 g/mol
SMILES C1([C@](CCC(O)CCC)([C@](C)(CC[C@]1(C)[H])[H])[H])(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926947