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cis-2-Ethyl-3,3,4-trimethylcyclopentanone

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

cis-2-Ethyl-3,3,4-trimethylcyclopentanone
SpectraBase Compound ID 9PbVcnnviVf
InChI InChI=1S/C10H18O/c1-5-8-9(11)6-7(2)10(8,3)4/h7-8H,5-6H2,1-4H3/t7-,8+/m1/s1
InChIKey FNMXSHGGGINGPA-SFYZADRCSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6t2bTkPsFnD
Name cis-2-Ethyl-3,3,4-trimethylcyclopentanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 154.135765199 u
Formula C10H18O
InChI InChI=1S/C10H18O/c1-5-8-9(11)6-7(2)10(8,3)4/h7-8H,5-6H2,1-4H3/t7-,8+/m1/s1
InChIKey FNMXSHGGGINGPA-SFYZADRCSA-N
Molecular Weight 154.253 g/mol
SMILES C1([C@](C(=O)C[C@]1(C)[H])(CC)[H])(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962282