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Ethyl 2-[1-(N-Ethoxycarbonylamino)-4-phenylcyclohexyl]prop-2-enoate isomer
SpectraBase Compound ID 4J6YxoTtOua
InChI InChI=1S/C20H27NO4/c1-4-24-18(22)15(3)20(21-19(23)25-5-2)13-11-17(12-14-20)16-9-7-6-8-10-16/h6-10,17H,3-5,11-14H2,1-2H3,(H,21,23)
InChIKey YAWVLHRWMSAWDI-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C20H27NO4
Exact Mass 345.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GtAEKpFoRSD
Name Ethyl 2-[1-(N-Ethoxycarbonylamino)-4-phenylcyclohexyl]prop-2-enoate isomer
Comments Less than 3 mono-isotopic peaks
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Formula C20H27NO4
InChI InChI=1S/C20H27NO4/c1-4-24-18(22)15(3)20(21-19(23)25-5-2)13-11-17(12-14-20)16-9-7-6-8-10-16/h6-10,17H,3-5,11-14H2,1-2H3,(H,21,23)
InChIKey YAWVLHRWMSAWDI-UHFFFAOYSA-N
Molecular Weight 345.439 g/mol
SMILES N(C1(C(C(=O)OCC)=C)CCC(CC1)c1ccccc1)C(=O)OCC
SPLASH splash10-0006-9000000000-a8a0b69fffd1694358c8
Source of Spectrum AT-44-8470-5
Synonyms ethyl 2-{1-[(ethoxycarbonyl)amino]-4-phenylcyclohexyl}acrylate
Wiley ID 1621713