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7-Oxabicyclo[4.1.0]heptan-2-ol, 4-ethenyl-4-methyl-5-(1-methylethenyl)-, (1.alpha.,2.alpha.,4.beta.,5.alpha.,6.alpha.)-(.+-.)-
SpectraBase Compound ID FMMbPnUiG40
InChI InChI=1S/C12H18O2/c1-5-12(4)6-8(13)10-11(14-10)9(12)7(2)3/h5,8-11,13H,1-2,6H2,3-4H3
InChIKey QHWVUWAITBONDB-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BqgLhzAMewc
Name 7-Oxabicyclo[4.1.0]heptan-2-ol, 4-ethenyl-4-methyl-5-(1-methylethenyl)-, (1.alpha.,2.alpha.,4.beta.,5.alpha.,6.alpha.)-(.+-.)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 194.130679818 u
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-5-12(4)6-8(13)10-11(14-10)9(12)7(2)3/h5,8-11,13H,1-2,6H2,3-4H3
InChIKey QHWVUWAITBONDB-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C12C(C(O)CC(C2C(=C)C)(C=C)C)O1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909373