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2-[4,7-bis(2-ethoxy-2-keto-ethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid ethyl ester
SpectraBase Compound ID C2u8Uo6n3YG
InChI InChI=1S/C20H38N4O6/c1-4-28-18(25)15-22-9-7-21-8-10-23(16-19(26)29-5-2)12-14-24(13-11-22)17-20(27)30-6-3/h21H,4-17H2,1-3H3
InChIKey BPEUICGMDOXPJJ-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C20H38N4O6
Exact Mass 430.279135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BydcLKzo0J
Name 2-[4,7-bis(2-ethoxy-2-keto-ethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid ethyl ester
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Formula C20H38N4O6
InChI InChI=1S/C20H38N4O6/c1-4-28-18(25)15-22-9-7-21-8-10-23(16-19(26)29-5-2)12-14-24(13-11-22)17-20(27)30-6-3/h21H,4-17H2,1-3H3
InChIKey BPEUICGMDOXPJJ-UHFFFAOYSA-N
Molecular Weight 430.546 g/mol
SMILES N1CCN(CCN(CCN(CC1)CC(=O)OCC)CC(=O)OCC)CC(=O)OCC
SPLASH splash10-0a5i-1913000000-f6d165439598d33852ac
Source of Spectrum Y2-25-337-1
Synonyms 2-[4,7-bis(2-ethoxy-2-oxoethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid ethyl ester Ethyl 2-[4,7-bis(2-ethoxy-2-oxidanylidene-ethyl)-1,4,7,10-tetrazacyclododec-1-yl]ethanoate Ethyl 2-[4,7-bis(2-ethoxy-2-oxo-ethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetate
Wiley ID 1547118