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Eremophilane

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

Eremophilane
SpectraBase Compound ID Ec1SJRdBuOh
InChI InChI=1S/C15H28/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h11-14H,5-10H2,1-4H3/t12-,13+,14+,15+/m0/s1
InChIKey AJWBFJHTFGRNDG-GBJTYRQASA-N
Mol Weight 208.39 g/mol
Molecular Formula C15H28
Exact Mass 208.219101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I0JOBxMTDyF
Name Eremophilane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.219100902 u
Formula C15H28
InChI InChI=1S/C15H28/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h11-14H,5-10H2,1-4H3/t12-,13+,14+,15+/m0/s1
InChIKey AJWBFJHTFGRNDG-GBJTYRQASA-N
Molecular Weight 208.389 g/mol
SMILES [C@]12(C[C@](C(C)C)(CC[C@]2(CCC[C@@]1(C)[H])[H])[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964164