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1,4-bis[2'-(Aminocarbonyl)ethyl]-1,4,8,11-tetraazacyclotetradecane
SpectraBase Compound ID 2cmGQB4dJPs
InChI InChI=1S/C16H34N6O2/c17-15(23)3-11-21-9-1-5-19-7-8-20-6-2-10-22(14-13-21)12-4-16(18)24/h19-20H,1-14H2,(H2,17,23)(H2,18,24)
InChIKey KZQPHKWBBKPRFO-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C16H34N6O2
Exact Mass 342.274324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BtTkj8Y3Bru
Name 1,4-bis[2'-(Aminocarbonyl)ethyl]-1,4,8,11-tetraazacyclotetradecane
Comments Less than 3 mono-isotopic peaks
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Formula C16H34N6O2
InChI InChI=1S/C16H34N6O2/c17-15(23)3-11-21-9-1-5-19-7-8-20-6-2-10-22(14-13-21)12-4-16(18)24/h19-20H,1-14H2,(H2,17,23)(H2,18,24)
InChIKey KZQPHKWBBKPRFO-UHFFFAOYSA-N
Molecular Weight 342.488 g/mol
SMILES NC(CCN1CCN(CCCNCCNCCC1)CCC(=O)N)=O
SPLASH splash10-0005-0906000000-45ae500c2cedfc2278d5
Source of Spectrum K1-2003-3989-3
Synonyms 3-[4-(3-amino-3-oxopropyl)-1,4,8,11-tetraazacyclotetradecan-1-yl]propanamide 3-[4-(3-amino-3-oxopropyl)-1,4,8,11-tetrazacyclotetradec-1-yl]propanamide 3-[4-(3-amino-3-oxo-propyl)-1,4,8,11-tetrazacyclotetradec-1-yl]propanamide 3-[4-(3-azanyl-3-oxidanylidene-propyl)-1,4,8,11-tetrazacyclotetradec-1-yl]propanamide
Wiley ID 1521613