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{(1S,4S,7R)-4,8,8-Trimethyl-2-methylenebicyclo[5.2.0]non-4-yl}methanol (birkenol)
SpectraBase Compound ID CTUPWeKn5bt
InChI InChI=1S/C14H24O/c1-10-7-14(4,9-15)6-5-12-11(10)8-13(12,2)3/h11-12,15H,1,5-9H2,2-4H3/t11-,12-,14+/m1/s1
InChIKey YLDRPYZNHCKPGS-BZPMIXESSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2sVwLdfeoAk
Name {(1S,4S,7R)-4,8,8-Trimethyl-2-methylenebicyclo[5.2.0]non-4-yl}methanol (birkenol)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-10-7-14(4,9-15)6-5-12-11(10)8-13(12,2)3/h11-12,15H,1,5-9H2,2-4H3/t11-,12-,14+/m1/s1
InChIKey YLDRPYZNHCKPGS-BZPMIXESSA-N
Molecular Weight 208.345 g/mol
SMILES [C@@]12(C(C[C@](CO)(C)CC[C@@]2([H])C(C1)(C)C)=C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.816242