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6-Ethyl-1-methylbicyclo[2.2.1]heptan-2-one

View entire compound with spectra: 1 FTIR

6-Ethyl-1-methylbicyclo[2.2.1]heptan-2-one
SpectraBase Compound ID hw2Gr8zJYn
InChI InChI=1S/C10H16O/c1-3-8-4-7-5-9(11)10(8,2)6-7/h7-8H,3-6H2,1-2H3/t7-,8-,10+/m0/s1
InChIKey JMLPVNOETCBEQR-OYNCUSHFSA-N
Mol Weight 152.24 g/mol
Molecular Formula C10H16O
Exact Mass 152.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JTghMPGeYfM
Name 6-Ethyl-1-methylbicyclo[2.2.1]heptan-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 152.120115134 u
Formula C10H16O
InChI InChI=1S/C10H16O/c1-3-8-4-7-5-9(11)10(8,2)6-7/h7-8H,3-6H2,1-2H3/t7-,8-,10+/m0/s1
InChIKey JMLPVNOETCBEQR-OYNCUSHFSA-N
Molecular Weight 152.237 g/mol
SMILES [C@]12(CC([C@@](C2)(C)[C@](C1)(CC)[H])=O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.977206