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3-(3,3-Dimethyl-1-propen-3-yl)-2-methylcyclopentanone

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

3-(3,3-Dimethyl-1-propen-3-yl)-2-methylcyclopentanone
SpectraBase Compound ID HdYeiTfiarv
InChI InChI=1S/C11H18O/c1-5-11(3,4)9-6-7-10(12)8(9)2/h5,8-9H,1,6-7H2,2-4H3
InChIKey VCJHPJMVAUIGQY-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 BPmrr0pdUKa
Name 3-(3,3-Dimethyl-1-propen-3-yl)-2-methylcyclopentanone
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/c1-5-11(3,4)9-6-7-10(12)8(9)2/h5,8-9H,1,6-7H2,2-4H3
InChIKey VCJHPJMVAUIGQY-UHFFFAOYSA-N
Molecular Weight 166.264 g/mol
SMILES C1(C(C(=O)CC1)C)C(C=C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.872455