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1,3-Di-tert-butyl 4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylate
SpectraBase Compound ID 5XYX8nitgG
InChI InChI=1S/C33H45NO7/c1-31(2,3)40-29(35)27-23(34-18-17-21-15-16-24(38-8)25(19-21)39-9)20-33(7,37)28(30(36)41-32(4,5)6)26(27)22-13-11-10-12-14-22/h10-16,19,26,28,34,37H,17-18,20H2,1-9H3
InChIKey LMELPGRPUBIOAU-UHFFFAOYSA-N
Mol Weight 567.7 g/mol
Molecular Formula C33H45NO7
Exact Mass 567.319603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3EtcfHJmPMR
Name 1,3-Di-tert-butyl 4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylate
Alternate Name(s) 3-Cyclohexene-1,3-dicarboxylic acid, 4-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-6-hydroxy-6-methyl-2-phenyl-, bis(1,1-dimethylethyl) ester 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylic acid ditert-butyl ester ditert-butyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenylcyclohex-3-ene-1,3-dicarboxylate ditert-butyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-hydroxy-6-methyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylate ditert-butyl 4-[2-(3,4-dimethoxyphenyl)ethylamino]-6-methyl-6-oxidanyl-2-phenyl-cyclohex-3-ene-1,3-dicarboxylate
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Formula C33H45NO7
InChI InChI=1S/C33H45NO7/c1-31(2,3)40-29(35)27-23(34-18-17-21-15-16-24(38-8)25(19-21)39-9)20-33(7,37)28(30(36)41-32(4,5)6)26(27)22-13-11-10-12-14-22/h10-16,19,26,28,34,37H,17-18,20H2,1-9H3
InChIKey LMELPGRPUBIOAU-UHFFFAOYSA-N
Molecular Weight 567.723 g/mol
SMILES OC1(C(C(C(=C(C1)NCCc1cc(c(OC)cc1)OC)C(OC(C)(C)C)=O)c1ccccc1)C(OC(C)(C)C)=O)C
SPLASH splash10-0ldi-7933450000-cd816ebea9c502ccc749
Source of Spectrum IY-2-5050-0
Wiley ID 1658483