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2-Butanone, 1-(3-ethyl-1-cyclohexen-1-yl)-3,3-dimethyl-

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

2-Butanone, 1-(3-ethyl-1-cyclohexen-1-yl)-3,3-dimethyl-
SpectraBase Compound ID 3cP1G1P4mJr
InChI InChI=1S/C14H24O/c1-5-11-7-6-8-12(9-11)10-13(15)14(2,3)4/h9,11H,5-8,10H2,1-4H3
InChIKey ATUHQOJHEWRUCE-UHFFFAOYSA-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 8bMiCytGOJR
Name 2-Butanone, 1-(3-ethyl-1-cyclohexen-1-yl)-3,3-dimethyl-
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/c1-5-11-7-6-8-12(9-11)10-13(15)14(2,3)4/h9,11H,5-8,10H2,1-4H3
InChIKey ATUHQOJHEWRUCE-UHFFFAOYSA-N
Molecular Weight 208.345 g/mol
SMILES C(CC1=CC(CC)CCC1)(C(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920815