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1,4,7,15,18-Pentaoxa-12,21-diazacyclopentacosane-8,11,22,25-tetrone

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1,4,7,15,18-Pentaoxa-12,21-diazacyclopentacosane-8,11,22,25-tetrone
SpectraBase Compound ID 4U4Fqy0njHM
InChI InChI=1S/C18H30N2O9/c21-15-1-3-17(23)28-13-11-27-12-14-29-18(24)4-2-16(22)20-6-8-26-10-9-25-7-5-19-15/h1-14H2,(H,19,21)(H,20,22)
InChIKey FGHSMTQTMROYQK-UHFFFAOYSA-N
Mol Weight 418.44 g/mol
Molecular Formula C18H30N2O9
Exact Mass 418.195131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AswmicXGMTe
Name 1,4,7,15,18-Pentaoxa-12,21-diazacyclopentacosane-8,11,22,25-tetrone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.195130545 u
Formula C18H30N2O9
InChI InChI=1S/C18H30N2O9/c21-15-1-3-17(23)28-13-11-27-12-14-29-18(24)4-2-16(22)20-6-8-26-10-9-25-7-5-19-15/h1-14H2,(H,19,21)(H,20,22)
InChIKey FGHSMTQTMROYQK-UHFFFAOYSA-N
Molecular Weight 418.443 g/mol
SMILES C1(NCCOCCOCCNC(CCC(OCCOCCOC(CC1)=O)=O)=O)=O