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Ethyl 2-{[1',6'-dimethyl-3'-[(N-methylphenylamino)methylene]-2'-oxocyclohexyl}-acetate
SpectraBase Compound ID 2P6oRDw8T9I
InChI InChI=1S/C20H27NO3/c1-5-24-18(22)13-20(3)15(2)11-12-16(19(20)23)14-21(4)17-9-7-6-8-10-17/h6-10,14-15H,5,11-13H2,1-4H3/b16-14-/t15-,20+/m1/s1
InChIKey MDYSTYJNMOSWKU-ATWDLZANSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YWNP4VaDTe
Name Ethyl 2-{[1',6'-dimethyl-3'-[(N-methylphenylamino)methylene]-2'-oxocyclohexyl}-acetate
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Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-5-24-18(22)13-20(3)15(2)11-12-16(19(20)23)14-21(4)17-9-7-6-8-10-17/h6-10,14-15H,5,11-13H2,1-4H3/b16-14-/t15-,20+/m1/s1
InChIKey MDYSTYJNMOSWKU-ATWDLZANSA-N
Molecular Weight 329.440 g/mol
SMILES C1(\C(CC[C@]([C@@]1(CC(=O)OCC)C)(C)[H])=C/N(c1ccccc1)C)=O
SPLASH splash10-0036-0095000000-673f1a2d88fb2abe8a13
Source of Spectrum QE-15-914-14
Synonyms {(1S,6R)-1,6-Dimethyl-3-[1-(methyl-phenyl-amino)-eth-(Z)-ylidene]-2-oxo-cyclohexyl}-acetic acid ethyl ester 2-[(1S,3Z,6R)-1,6-dimethyl-3-[(N-methylanilino)methylidene]-2-oxocyclohexyl]acetic acid ethyl ester Ethyl 2-[(1S,3Z,6R)-1,6-dimethyl-3-[(N-methylanilino)methylidene]-2-oxocyclohexyl]acetate Ethyl 2-[(1S,3Z,6R)-1,6-dimethyl-3-[(N-methylanilino)methylene]-2-oxo-cyclohexyl]acetate Ethyl 2-[(1S,3Z,6R)-1,6-dimethyl-3-[[methyl(phenyl)amino]methylidene]-2-oxidanylidene-cyclohexyl]ethanoate
Wiley ID 1692659