(1R,2S,5R)-5-Methyl-2-[1-methyl-1-(4-methoxyphenyl)ethyl]cyclohexyl (1R,4S)-2-Oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate

SpectraBase Compound ID	8c8z952BQJj
InChI	InChI=1S/C24H33NO4/c1-16-5-14-21(24(2,3)17-6-10-19(27-4)11-7-17)22(15-16)28-23(26)25-18-8-12-20(29-25)13-9-18/h6-8,10-12,16,18,20-22H,5,9,13-15H2,1-4H3/t16-,18-,20+,21-,22-/m1/s1
InChIKey	DABMLMBTSHZVPD-AFSNDHJISA-N Google Search
Mol Weight	399.5 g/mol
Molecular Formula	C24H33NO4
Exact Mass	399.240959 g/mol

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SpectraBase Spectrum ID	D3D1hhdpOmj
Name	(1R,2S,5R)-5-Methyl-2-[1-methyl-1-(4-methoxyphenyl)ethyl]cyclohexyl (1R,4S)-2-Oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate
Alternate Name(s)	(1R,2S,5R)-2-[1-(4-methoxyphenyl)-1-methylethyl]-5-methylcyclohexyl 2-oxa-3-azabicyclo[2.2.2]oct-5-ene-3-carboxylate (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid [(1R,2S,5R)-2-[2-(4-methoxyphenyl)propan-2-yl]-5-methylcyclohexyl] ester [(1R,2S,5R)-2-[2-(4-methoxyphenyl)propan-2-yl]-5-methylcyclohexyl] (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate [(1R,2S,5R)-2-[1-(4-methoxyphenyl)-1-methyl-ethyl]-5-methyl-cyclohexyl] (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate [(1R,2S,5R)-2-[2-(4-methoxyphenyl)propan-2-yl]-5-methyl-cyclohexyl] (1S,4R)-3-oxa-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H33NO4
InChI	InChI=1S/C24H33NO4/c1-16-5-14-21(24(2,3)17-6-10-19(27-4)11-7-17)22(15-16)28-23(26)25-18-8-12-20(29-25)13-9-18/h6-8,10-12,16,18,20-22H,5,9,13-15H2,1-4H3/t16-,18-,20+,21-,22-/m1/s1
InChIKey	DABMLMBTSHZVPD-AFSNDHJISA-N
Molecular Weight	399.531 g/mol
SMILES	C(N1O[C@]2(C=C[C@@]1(CC2)[H])[H])(O[C@]1([C@](C(c2ccc(cc2)OC)(C)C)(CC[C@](C1)(C)[H])[H])[H])=O
SPLASH	splash10-000j-0900000000-adf4627332dfe534ab87
Source of Spectrum	J-63-8403-14
Wiley ID	1369074