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3-Ethoxy-6-ethylcyclohex-2-en-1-one
SpectraBase Compound ID 25MKcJxTKA6
InChI InChI=1S/C10H16O2/c1-3-8-5-6-9(12-4-2)7-10(8)11/h7-8H,3-6H2,1-2H3
InChIKey MDJANMQJJAAFGW-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lvur5qiOMUM
Name 3-Ethoxy-6-ethylcyclohex-2-en-1-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.115029753 u
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-3-8-5-6-9(12-4-2)7-10(8)11/h7-8H,3-6H2,1-2H3
InChIKey MDJANMQJJAAFGW-UHFFFAOYSA-N
Instrument Name Agilent MS5977A MSD-Agilent 7890 B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201700837
Molecular Weight 168.236 g/mol
Quality 196
Reported Formula C10H16O2
SMILES C(C)OC1=CC(C(CC1)CC)=O
SPLASH splash10-029x-4900000000-442c7c9494b2c7be1245
Source of Spectrum ACI-56-SM26-20 (DOI: 10.1002/anie.201700837)
Thin-Layer Chromatography 0.19 (P/Et2O, 3:1) [UV/KMnO4]
Wiley ID 1895691