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1-Cyclohexene-1-carboxaldehyde, 5-(1,1-dimethylethyl)-

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1-Cyclohexene-1-carboxaldehyde, 5-(1,1-dimethylethyl)-
SpectraBase Compound ID 9kdoUVENCCI
InChI InChI=1S/C11H18O/c1-11(2,3)10-6-4-5-9(7-10)8-12/h5,8,10H,4,6-7H2,1-3H3
InChIKey IHRONRZIIVLLHE-UHFFFAOYSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6hCUOaBRW8N
Name 1-Cyclohexene-1-carboxaldehyde, 5-(1,1-dimethylethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 166.135765199 u
Formula C11H18O
InChI InChI=1S/C11H18O/c1-11(2,3)10-6-4-5-9(7-10)8-12/h5,8,10H,4,6-7H2,1-3H3
InChIKey IHRONRZIIVLLHE-UHFFFAOYSA-N
Molecular Weight 166.264 g/mol
SMILES C=1(CC(C(C)(C)C)CCC1)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978758