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1-Formyl-7-(2-hydroxyhexadecyl)-1,4,7,10-tetraazacyclododecane

View entire compound with spectra: 1 MS (GC)

1-Formyl-7-(2-hydroxyhexadecyl)-1,4,7,10-tetraazacyclododecane
SpectraBase Compound ID 60kXFn2IrUY
InChI InChI=1S/C25H52N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-25(31)23-28-19-15-26-17-21-29(24-30)22-18-27-16-20-28/h24-27,31H,2-23H2,1H3
InChIKey AMSKIWMTBGBDJU-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C25H52N4O2
Exact Mass 440.409027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HIyhmu6ujLm
Name 1-Formyl-7-(2-hydroxyhexadecyl)-1,4,7,10-tetraazacyclododecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H52N4O2
InChI InChI=1S/C25H52N4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-25(31)23-28-19-15-26-17-21-29(24-30)22-18-27-16-20-28/h24-27,31H,2-23H2,1H3
InChIKey AMSKIWMTBGBDJU-UHFFFAOYSA-N
Molecular Weight 440.717 g/mol
SMILES N1CCN(CC(O)CCCCCCCCCCCCCC)CCNCCN(C=O)CC1
SPLASH splash10-001i-0090000000-bf16c7b39f8af216ae37
Source of Spectrum KC-0-1048-7
Synonyms 7-(2-hydroxyhexadecyl)-1,4,7,10-tetraazacyclododecane-1-carbaldehyde 7-(2-hydroxyhexadecyl)-1,4,7,10-tetrazacyclododecane-1-carboxaldehyde 7-(2-oxidanylhexadecyl)-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
Wiley ID 830768