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(+)-( 2S,1"S,2"R)-1-{1'-(4"-Bromophenyl)-2'-[ 2"-(ethoxycarbonyl)cyclopentyl] ethylideneamino }-2-(methoxymethyl)pyrrolidine

View entire compound with spectra: 1 MS (GC)

(+)-( 2S,1"S,2"R)-1-{1'-(4"-Bromophenyl)-2'-[ 2"-(ethoxycarbonyl)cyclopentyl] ethylideneamino }-2-(methoxymethyl)pyrrolidine
SpectraBase Compound ID 1HdQEdPPHct
InChI InChI=1S/C22H31BrN2O3/c1-27-15-19-7-5-13-25(19)24-21(16-9-11-18(23)12-10-16)14-17-6-3-4-8-20(17)22(26)28-2/h9-12,17,19-20H,3-8,13-15H2,1-2H3/b24-21-/t17-,19-,20+/m0/s1
InChIKey PCQPWPXJIUWNEC-HXKBANIQSA-N
Mol Weight 451.41 g/mol
Molecular Formula C22H31BrN2O3
Exact Mass 450.151806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbuMMvyDaAK
Name (+)-( 2S,1"S,2"R)-1-{1'-(4"-Bromophenyl)-2'-[ 2"-(ethoxycarbonyl)cyclopentyl] ethylideneamino }-2-(methoxymethyl)pyrrolidine
Alternate Name(s) Methyl (1R,2S)-2-((2Z)-2-(4-bromophenyl)-2-{[(2S)-2-(methoxymethyl)pyrrolidinyl]imino}ethyl)cyclohexanecarboxylate
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Formula C22H31BrN2O3
InChI InChI=1S/C22H31BrN2O3/c1-27-15-19-7-5-13-25(19)24-21(16-9-11-18(23)12-10-16)14-17-6-3-4-8-20(17)22(26)28-2/h9-12,17,19-20H,3-8,13-15H2,1-2H3/b24-21-/t17-,19-,20+/m0/s1
InChIKey PCQPWPXJIUWNEC-HXKBANIQSA-N
Molecular Weight 451.405 g/mol
SMILES [C@]1(N(\N=C\(C[C@]2([C@](C(=O)OC)(CCCC2)[H])[H])c2ccc(cc2)Br)CCC1)(COC)[H]
SPLASH splash10-0a4i-2000900000-afe86e543d82623da7ce
Source of Spectrum K-126-1936-15
Wiley ID 1387633