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2-Cyclohepten-1-one, 5-(methoxymethyl)-3,5-dimethyl-

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

2-Cyclohepten-1-one, 5-(methoxymethyl)-3,5-dimethyl-
SpectraBase Compound ID DDrglYG60U2
InChI InChI=1S/C11H18O2/c1-9-6-10(12)4-5-11(2,7-9)8-13-3/h6H,4-5,7-8H2,1-3H3
InChIKey PIADAJFEQQYXNG-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Dig4uP3TLqe
Name 2-Cyclohepten-1-one, 5-(methoxymethyl)-3,5-dimethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 182.130679818 u
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-9-6-10(12)4-5-11(2,7-9)8-13-3/h6H,4-5,7-8H2,1-3H3
InChIKey PIADAJFEQQYXNG-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES C1(=CC(=O)CCC(C1)(COC)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961271