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(1S,2R,12S)-4,8,12-Trimethyl-1-(1-methylenethyl)cyclotetradeca-3,7-dien-2-ol

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

(1S,2R,12S)-4,8,12-Trimethyl-1-(1-methylenethyl)cyclotetradeca-3,7-dien-2-ol
SpectraBase Compound ID 5WVDmfouS5c
InChI InChI=1S/C20H34O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h9,14,17,19-21H,1,6-8,10-13H2,2-5H3/b16-9+,18-14+/t17-,19-,20+/m0/s1
InChIKey RRFRKWYNRAPELG-GZBIWBSHSA-N
Mol Weight 290.5 g/mol
Molecular Formula C20H34O
Exact Mass 290.260966 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H7WBuc7xcHa
Name (1S,2R,12S)-4,8,12-Trimethyl-1-(1-methylenethyl)cyclotetradeca-3,7-dien-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.260965714 u
Formula C20H34O
InChI InChI=1S/C20H34O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h9,14,17,19-21H,1,6-8,10-13H2,2-5H3/b16-9+,18-14+/t17-,19-,20+/m0/s1
InChIKey RRFRKWYNRAPELG-GZBIWBSHSA-N
SMILES [C@]1(\C=C\(CC\C=C\(CCC[C@@](CC[C@]1(C(=C)C)[H])(C)[H])C)C)(O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934121