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16-Oxo-16,17-dihydro-5H,15H-dibenzo[b,i][1,11,4,5,7,8]dioxatetraazacyclotetradecine-7-carbonitrile
SpectraBase Compound ID KXhgWYNIbiu
InChI InChI=1S/C17H13N5O3/c18-9-17-21-19-13-5-1-3-7-15(13)24-10-12(23)11-25-16-8-4-2-6-14(16)20-22-17/h1-8,19H,10-11H2/b21-17-,22-20-
InChIKey KRJDECSLZDHCGK-VXTJRRPDSA-N
Mol Weight 335.32 g/mol
Molecular Formula C17H13N5O3
Exact Mass 335.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMlh6w9lMgi
Name 16-Oxo-16,17-dihydro-5H,15H-dibenzo[b,i][1,11,4,5,7,8]dioxatetraazacyclotetradecine-7-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13N5O3
InChI InChI=1S/C17H13N5O3/c18-9-17-21-19-13-5-1-3-7-15(13)24-10-12(23)11-25-16-8-4-2-6-14(16)20-22-17/h1-8,19H,10-11H2/b21-17-,22-20-
InChIKey KRJDECSLZDHCGK-VXTJRRPDSA-N
Molecular Weight 335.323 g/mol
SMILES N1c2c(OCC(COc3c(\N=N/C(=N\1)C#N)cccc3)=O)cccc2
SPLASH splash10-0fkm-7903000000-b389e0f6e338d5dc7f58
Source of Spectrum F-54-12427-8
Wiley ID 809186