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Methyl 6,6-Dimethyl-3-[2-((S)-2-diethylaminomethyl-pyrrolidin-1yl)-2-oxoethyl]-5-oxoheptanoate
SpectraBase Compound ID 6NI65OvwL2w
InChI InChI=1S/C21H38N2O4/c1-7-22(8-2)15-17-10-9-11-23(17)19(25)13-16(14-20(26)27-6)12-18(24)21(3,4)5/h16-17H,7-15H2,1-6H3/t16?,17-/m0/s1
InChIKey NZBYFXVESXPKCN-DJNXLDHESA-N
Mol Weight 382.5 g/mol
Molecular Formula C21H38N2O4
Exact Mass 382.283158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HLYNh2sjJO
Name Methyl 6,6-Dimethyl-3-[2-((S)-2-diethylaminomethyl-pyrrolidin-1yl)-2-oxoethyl]-5-oxoheptanoate
Alternate Name(s) Methyl 3-(2-{(2S)-2-[(diethylamino)methyl]pyrrolidinyl}-2-oxoethyl)-6,6-dimethyl-5-oxoheptanoate Methyl 6,6-Dimethyl-3-[2-((N,N-diethylmethyl)pyrrolidinyl)-2-oxoethyl]-5-oxoheptanoate
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Formula C21H38N2O4
InChI InChI=1S/C21H38N2O4/c1-7-22(8-2)15-17-10-9-11-23(17)19(25)13-16(14-20(26)27-6)12-18(24)21(3,4)5/h16-17H,7-15H2,1-6H3/t16?,17-/m0/s1
InChIKey NZBYFXVESXPKCN-DJNXLDHESA-N
Molecular Weight 382.545 g/mol
SMILES C(N1[C@](CN(CC)CC)(CCC1)[H])(CC(CC(C(C)(C)C)=O)CC(=O)OC)=O
SPLASH splash10-000i-9210000000-e256bbd97421d8115275
Source of Spectrum F-52-14592-27
Wiley ID 799665