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1-Ethyl-5-[(1R,2S,5R)-8-Phenylmenthyl](2S,3S)-2-(N,N-dibenzylamino)-3-phenylglutarate

View entire compound with spectra: 1 MS (GC)

1-Ethyl-5-[(1R,2S,5R)-8-Phenylmenthyl](2S,3S)-2-(N,N-dibenzylamino)-3-phenylglutarate
SpectraBase Compound ID Eo08FIcYxlI
InChI InChI=1S/C43H51NO4/c1-5-47-42(46)41(44(30-33-18-10-6-11-19-33)31-34-20-12-7-13-21-34)37(35-22-14-8-15-23-35)29-40(45)48-39-28-32(2)26-27-38(39)43(3,4)36-24-16-9-17-25-36/h6-25,32,37-39,41H,5,26-31H2,1-4H3/t32-,37+,38-,39-,41+/m1/s1
InChIKey BABKGBMWOTXMRX-LBDRCFAISA-N
Mol Weight 645.9 g/mol
Molecular Formula C43H51NO4
Exact Mass 645.381809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Fj6uy8dH6t
Name 1-Ethyl-5-[(1R,2S,5R)-8-Phenylmenthyl](2S,3S)-2-(N,N-dibenzylamino)-3-phenylglutarate
Alternate Name(s) (2S,3S)-2-(dibenzylamino)-3-phenyl-glutaric acid O5-[(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl]ester O1-ethyl ester (2S,3S)-2-[bis(phenylmethyl)amino]-3-phenylpentanedioic acid O1-ethyl ester O5-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl]ester 1-Ethyl 5-[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenylethyl)cyclohexyl](2S,3S)-2-(dibenzylamino)-3-phenylpentanedioate 1-O-ethyl 5-O-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl](2S,3S)-2-(dibenzylamino)-3-phenylpentanedioate O1-ethyl O5-[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl](2S,3S)-2-(dibenzylamino)-3-phenyl-pentanedioate O1-ethyl O5-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl](2S,3S)-2-[bis(phenylmethyl)amino]-3-phenyl-pentanedioate (2S,3S)-2-[bis(phenylmethyl)amino]-3-phenylpentanedioic acid O1-ethyl ester O5-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester 1-O-ethyl 5-O-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S,3S)-2-(dibenzylamino)-3-phenylpentanedioate O1-ethyl O5-[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (2S,3S)-2-(dibenzylamino)-3-phenyl-pentanedioate O1-ethyl O5-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2S,3S)-2-[bis(phenylmethyl)amino]-3-phenyl-pentanedioate
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Formula C43H51NO4
InChI InChI=1S/C43H51NO4/c1-5-47-42(46)41(44(30-33-18-10-6-11-19-33)31-34-20-12-7-13-21-34)37(35-22-14-8-15-23-35)29-40(45)48-39-28-32(2)26-27-38(39)43(3,4)36-24-16-9-17-25-36/h6-25,32,37-39,41H,5,26-31H2,1-4H3/t32-,37+,38-,39-,41+/m1/s1
InChIKey BABKGBMWOTXMRX-LBDRCFAISA-N
Molecular Weight 645.884 g/mol
SMILES [C@@](N(Cc1ccccc1)Cc1ccccc1)([C@@](CC(O[C@]1([C@](C(c2ccccc2)(C)C)(CC[C@](C1)(C)[H])[H])[H])=O)(c1ccccc1)[H])(C(=O)OCC)[H]
SPLASH splash10-001i-0090000000-0fee4ebb751bf3e0b18a
Source of Spectrum J-64-6562-6
Wiley ID 1530976