1,3-Di-tert-butyl 2-(4-chlorophenyl)-6-hydroxy-6-methyl-4-[(2-phenylethyl)amino]cyclohex-3-ene-1,3-dicarboxylate

SpectraBase Compound ID	BgurmarPYcm
InChI	InChI=1S/C31H40ClNO5/c1-29(2,3)37-27(34)25-23(33-18-17-20-11-9-8-10-12-20)19-31(7,36)26(28(35)38-30(4,5)6)24(25)21-13-15-22(32)16-14-21/h8-16,24,26,33,36H,17-19H2,1-7H3
InChIKey	QFKUHUDGCQIAIR-UHFFFAOYSA-N Google Search
Mol Weight	542.1 g/mol
Molecular Formula	C31H40ClNO5
Exact Mass	541.259501 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	25Kd3665Hxl
Name	1,3-Di-tert-butyl 2-(4-chlorophenyl)-6-hydroxy-6-methyl-4-[(2-phenylethyl)amino]cyclohex-3-ene-1,3-dicarboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C31H40ClNO5
InChI	InChI=1S/C31H40ClNO5/c1-29(2,3)37-27(34)25-23(33-18-17-20-11-9-8-10-12-20)19-31(7,36)26(28(35)38-30(4,5)6)24(25)21-13-15-22(32)16-14-21/h8-16,24,26,33,36H,17-19H2,1-7H3
InChIKey	QFKUHUDGCQIAIR-UHFFFAOYSA-N
Molecular Weight	542.116 g/mol
SMILES	OC1(C(C(C(=C(C1)NCCc1ccccc1)C(OC(C)(C)C)=O)c1ccc(cc1)Cl)C(OC(C)(C)C)=O)C
SPLASH	splash10-0a4i-8968620000-4b14980df67609562276
Source of Spectrum	IY-2-5051-4
Synonyms	3-Cyclohexene-1,3-dicarboxylic acid, 2-(4-chlorophenyl)-6-hydroxy-6-methyl-4-[(2-phenylethyl)amino]-, bis(1,1-dimethylethyl) ester 2-(4-Chlorophenyl)-6-hydroxy-6-methyl-4-(2-phenylethylamino)cyclohex-3-ene-1,3-dicarboxylic acid ditert-butyl ester ditert-butyl 2-(4-chlorophenyl)-6-hydroxy-6-methyl-4-(2-phenylethylamino)cyclohex-3-ene-1,3-dicarboxylate ditert-butyl 2-(4-chlorophenyl)-6-methyl-6-oxidanyl-4-(2-phenylethylamino)cyclohex-3-ene-1,3-dicarboxylate
Wiley ID	1658497