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7-[3-(dioctylamino)-2-hydroxy-propyl]-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
SpectraBase Compound ID 4B7nIZ3WVcF
InChI InChI=1S/C28H59N5O2/c1-3-5-7-9-11-13-19-31(20-14-12-10-8-6-4-2)25-28(35)26-32-21-15-29-17-23-33(27-34)24-18-30-16-22-32/h27-30,35H,3-26H2,1-2H3
InChIKey TZXYKLMFNHSWQY-UHFFFAOYSA-N
Mol Weight 497.8 g/mol
Molecular Formula C28H59N5O2
Exact Mass 497.466876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUZH3tkchAg
Name 7-[3-(dioctylamino)-2-hydroxy-propyl]-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H59N5O2
InChI InChI=1S/C28H59N5O2/c1-3-5-7-9-11-13-19-31(20-14-12-10-8-6-4-2)25-28(35)26-32-21-15-29-17-23-33(27-34)24-18-30-16-22-32/h27-30,35H,3-26H2,1-2H3
InChIKey TZXYKLMFNHSWQY-UHFFFAOYSA-N
Molecular Weight 497.813 g/mol
SMILES N1CCN(CC(CN(CCCCCCCC)CCCCCCCC)O)CCNCCN(CC1)C=O
SPLASH splash10-0f7o-0090000000-1e474d8162f39d091036
Source of Spectrum K-2001-931-5
Synonyms 7-[3-(dioctylamino)-2-hydroxypropyl]-1,4,7,10-tetrazacyclododecane-1-carboxaldehyde 7-[3-(dioctylamino)-2-oxidanyl-propyl]-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
Wiley ID 1580373