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1,5,10-Triazacyclodocosan-11-one
SpectraBase Compound ID LV4CZK0d0fD
InChI InChI=1S/C19H39N3O/c23-19-13-8-6-4-2-1-3-5-7-9-14-20-16-12-17-21-15-10-11-18-22-19/h20-21H,1-18H2,(H,22,23)
InChIKey DFWVVXABNJZRCR-UHFFFAOYSA-N
Mol Weight 325.5 g/mol
Molecular Formula C19H39N3O
Exact Mass 325.309313 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EW6NMjaCMQX
Name 1,5,10-Triazacyclodocosan-11-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.309312887 u
Formula C19H39N3O
InChI InChI=1S/C19H39N3O/c23-19-13-8-6-4-2-1-3-5-7-9-14-20-16-12-17-21-15-10-11-18-22-19/h20-21H,1-18H2,(H,22,23)
InChIKey DFWVVXABNJZRCR-UHFFFAOYSA-N
Molecular Weight 325.541 g/mol
SMILES C1(NCCCCNCCCNCCCCCCCCCCC1)=O