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N,N'-Diethyl-N,N'-bis-(4-phenylbutyl)-benzol-1,3-dimethanamin-dihydrogenoxalate
SpectraBase Compound ID 7TzkiW778Br
InChI InChI=1S/C32H44N2.2C2H2O4/c1-3-33(24-13-11-20-29-16-7-5-8-17-29)27-31-22-15-23-32(26-31)28-34(4-2)25-14-12-21-30-18-9-6-10-19-30;2*3-1(4)2(5)6/h5-10,15-19,22-23,26H,3-4,11-14,20-21,24-25,27-28H2,1-2H3;2*(H,3,4)(H,5,6)
InChIKey JPAUUUVPPXONTJ-UHFFFAOYSA-N
Mol Weight 636.79 g/mol
Molecular Formula C36H48N2O8
Exact Mass 636.341067 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kq4gkOif3CA
Name N,N'-Diethyl-N,N'-bis-(4-phenylbutyl)-benzol-1,3-dimethanamin-dihydrogenoxalate
Alternate Name(s) N,N'-(1,3-phenylenebis(methylene))bis(N-ethyl-4-phenylbutan-1-amine) dioxalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H48N2O8
InChI InChI=1S/C32H44N2.2C2H2O4/c1-3-33(24-13-11-20-29-16-7-5-8-17-29)27-31-22-15-23-32(26-31)28-34(4-2)25-14-12-21-30-18-9-6-10-19-30;2*3-1(4)2(5)6/h5-10,15-19,22-23,26H,3-4,11-14,20-21,24-25,27-28H2,1-2H3;2*(H,3,4)(H,5,6)
InChIKey JPAUUUVPPXONTJ-UHFFFAOYSA-N
Molecular Weight 636.786 g/mol
SMILES c1(cc(ccc1)CN(CCCCc1ccccc1)CC)CN(CCCCc1ccccc1)CC.OC(C(=O)O)=O.OC(C(=O)O)=O
SPLASH splash10-0a4i-4906000000-8c58036723d69b628b9a
Source of Spectrum APC-322-813-3
Wiley ID 1788557