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7-(2-hydroxydodecyl)-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
SpectraBase Compound ID 8wMJIcWHUC2
InChI InChI=1S/C21H44N4O2/c1-2-3-4-5-6-7-8-9-10-21(27)19-24-15-11-22-13-17-25(20-26)18-14-23-12-16-24/h20-23,27H,2-19H2,1H3
InChIKey AHCJNQYGCIAWDV-UHFFFAOYSA-N
Mol Weight 384.6 g/mol
Molecular Formula C21H44N4O2
Exact Mass 384.346427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrH9QqZdrAr
Name 7-(2-hydroxydodecyl)-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
Alternate Name(s) 7-(2-hydroxydodecyl)-1,4,7,10-tetrazacyclododecane-1-carboxaldehyde 7-(2-oxidanyldodecyl)-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
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Formula C21H44N4O2
InChI InChI=1S/C21H44N4O2/c1-2-3-4-5-6-7-8-9-10-21(27)19-24-15-11-22-13-17-25(20-26)18-14-23-12-16-24/h20-23,27H,2-19H2,1H3
InChIKey AHCJNQYGCIAWDV-UHFFFAOYSA-N
Molecular Weight 384.609 g/mol
SMILES N1CCN(CC(O)CCCCCCCCCC)CCNCCN(C=O)CC1
SPLASH splash10-004i-0090000000-6debe62d195949da6421
Source of Spectrum KC-0-1048-7
Wiley ID 830769