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2,6,6-Trimethyl-3-isobutoxy-2-cyclohexen-1-one
SpectraBase Compound ID EzLIzzAt1to
InChI InChI=1S/C13H22O2/c1-9(2)8-15-11-6-7-13(4,5)12(14)10(11)3/h9H,6-8H2,1-5H3
InChIKey SXLMFWKZJWAAIB-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cdz7WImJCUV
Name 3-Isobutoxy-2,6,6-trimethyl-2-cyclohexen-1-one
Alternate Name(s) 2,6,6-trimethyl-3-(2-methylpropoxy)-1-cyclohex-2-enone 2,6,6-trimethyl-3-(2-methylpropoxy)cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-9(2)8-15-11-6-7-13(4,5)12(14)10(11)3/h9H,6-8H2,1-5H3
InChIKey SXLMFWKZJWAAIB-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
SMILES C1(CCC(=C(C1=O)C)OCC(C)C)(C)C
SPLASH splash10-014i-9000000000-63d5b4b95a16c8ffd9d5
Wiley ID 1471892