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1,5,10,17-Tetraacetyl-1,5,10,17-tetraazaheptadecane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,5,10,17-Tetraacetyl-1,5,10,17-tetraazaheptadecane
SpectraBase Compound ID 9FhfaRnecKB
InChI InChI=1S/C21H40N4O4/c1-18(26)22-12-7-5-6-8-14-24(20(3)28)15-9-10-16-25(21(4)29)17-11-13-23-19(2)27/h5-17H2,1-4H3,(H,22,26)(H,23,27)
InChIKey QRAYQYZIZIKKGM-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C21H40N4O4
Exact Mass 412.304956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5O4GvIsrPzM
Name 1,5,10,17-Tetraacetyl-1,5,10,17-tetraazaheptadecane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.304955780 u
Formula C21H40N4O4
InChI InChI=1S/C21H40N4O4/c1-18(26)22-12-7-5-6-8-14-24(20(3)28)15-9-10-16-25(21(4)29)17-11-13-23-19(2)27/h5-17H2,1-4H3,(H,22,26)(H,23,27)
InChIKey QRAYQYZIZIKKGM-UHFFFAOYSA-N
Molecular Weight 412.575 g/mol
SMILES C(NC(=O)C)CCN(CCCCN(CCCCCCNC(=O)C)C(=O)C)C(=O)C