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5,6,7,8-Tetrahydro-2H-1,11,4,8-benzodioxadiazacyclotridecine-3,9(4H,10H)-dione

View entire compound with spectra: 1 MS (GC)

5,6,7,8-Tetrahydro-2H-1,11,4,8-benzodioxadiazacyclotridecine-3,9(4H,10H)-dione
SpectraBase Compound ID 9KlMEFeuO6U
InChI InChI=1S/C13H16N2O4/c16-12-8-18-10-4-1-2-5-11(10)19-9-13(17)15-7-3-6-14-12/h1-2,4-5H,3,6-9H2,(H,14,16)(H,15,17)
InChIKey FQUFFHUTIXAHCZ-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTY9EAvvn2s
Name 5,6,7,8-Tetrahydro-2H-1,11,4,8-benzodioxadiazacyclotridecine-3,9(4H,10H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c16-12-8-18-10-4-1-2-5-11(10)19-9-13(17)15-7-3-6-14-12/h1-2,4-5H,3,6-9H2,(H,14,16)(H,15,17)
InChIKey FQUFFHUTIXAHCZ-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES N1CCCNC(COc2c(OCC1=O)cccc2)=O
SPLASH splash10-0006-9110000000-2b5efbd17dd9ffdc72bc
Source of Spectrum F4-0-1002-3
Wiley ID 1619428