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(+)-Ethyl 2-[(2R)-4-benzyl-2-(cyanomethyl)piperazin-1-yl]acetate
SpectraBase Compound ID 9TBTaDTm3JH
InChI InChI=1S/C17H23N3O2/c1-2-22-17(21)14-20-11-10-19(13-16(20)8-9-18)12-15-6-4-3-5-7-15/h3-7,16H,2,8,10-14H2,1H3/t16-/m1/s1
InChIKey PZKBNBHEHPBMRF-MRXNPFEDSA-N
Mol Weight 301.39 g/mol
Molecular Formula C17H23N3O2
Exact Mass 301.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oEMoJbqgiC
Name (+)-Ethyl 2-[(2R)-4-benzyl-2-(cyanomethyl)piperazin-1-yl]acetate
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Formula C17H23N3O2
InChI InChI=1S/C17H23N3O2/c1-2-22-17(21)14-20-11-10-19(13-16(20)8-9-18)12-15-6-4-3-5-7-15/h3-7,16H,2,8,10-14H2,1H3/t16-/m1/s1
InChIKey PZKBNBHEHPBMRF-MRXNPFEDSA-N
Molecular Weight 301.390 g/mol
SMILES [C@]1(N(CCN(C1)Cc1ccccc1)CC(=O)OCC)(CC#N)[H]
SPLASH splash10-0096-8593000000-c5988b4325deb7076be7
Source of Spectrum EMC-41-391-10a
Synonyms (R)-ethyl 2-(4-benzyl-2-(cyanomethyl)piperazin-1-yl)acetate 2-[(2R)-2-(cyanomethyl)-4-(phenylmethyl)-1-piperazinyl]acetic acid ethyl ester Ethyl 2-[(2R)-4-benzyl-2-(cyanomethyl)piperazin-1-yl]acetate Ethyl 2-[(2R)-2-(cyanomethyl)-4-(phenylmethyl)piperazin-1-yl]ethanoate
Wiley ID 1735004