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Azacyclotridecan-2-one, 1-[3-[[3-[(3-aminopropyl)amino]propyl]amino]propyl]-
SpectraBase Compound ID DLkTuCkKiXM
InChI InChI=1S/C21H44N4O/c22-14-10-15-23-16-11-17-24-18-12-20-25-19-9-7-5-3-1-2-4-6-8-13-21(25)26/h23-24H,1-20,22H2
InChIKey XPCVNNFFWUVTLA-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C21H44N4O
Exact Mass 368.351512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BLtjgLvmdY
Name Azacyclotridecan-2-one, 1-[3-[[3-[(3-aminopropyl)amino]propyl]amino]propyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.351512052 u
Formula C21H44N4O
InChI InChI=1S/C21H44N4O/c22-14-10-15-23-16-11-17-24-18-12-20-25-19-9-7-5-3-1-2-4-6-8-13-21(25)26/h23-24H,1-20,22H2
InChIKey XPCVNNFFWUVTLA-UHFFFAOYSA-N
Molecular Weight 368.610 g/mol
SMILES C1CCCCC(N(CCCCCC1)CCCNCCCNCCCN)=O